1-phenyltetrahydroisoquinolines

Description:

Compounds containing a phenyl group attached to the C1-atom of a tetrahydroisoquinoline moiety.

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  1. NVP-CGM097 sulfate
    CAS: 1313367-56-4 PubChem CID: 53262550 Formula: C38H49ClN4O8S Molecular Weight: 659.26
    Out of Stock Item #: N649940
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    IUPAC Name
    (1S)-1-(4-chlorophenyl)-6-methoxy-2-[4-[methyl-[[4-(4-methyl-3-oxopiperazin-1-yl)cyclohexyl]methyl]amino]phenyl]-7-propan-2-yloxy-1,4-dihydroisoquinolshow more
    SMILES
    CC(C)OC1=C(C=C2CC(=O)N(C(C2=C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)N(C)CC5CCC(CC5)N6CCN(C(=O)C6)C)OC.OS(=O)(=O)O
    InChIKey
    YFLKIFVIZIALIA-GHVGLMRRSA-N
    InChI
    1S/C38H47ClN4O4.H2O4S/c1-25(2)47-35-22-33-28(20-34(35)46-5)21-36(44)43(38(33)27-8-10-29(39)11-9-27)32-16-14-30(15-17-32)41(4)23-26-6-12-31(13-7-26)42-show more
  2. Solifenacin Hydrochloride
    CAS: 180468-39-7 PubChem CID: 154058 Formula: C23H27ClN2O2 Molecular Weight: 398.93
    In Stock Item #: S345270
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    IUPAC Name
    [(3R)-1-azabicyclo[2.2.2]octan-3-yl] (1S)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate;hydrochloride
    SMILES
    C1CN2CCC1C(C2)OC(=O)N3CCC4=CC=CC=C4C3C5=CC=CC=C5.Cl
    InChIKey
    YAUBKMSXTZQZEB-VROPFNGYSA-N
    InChI
    1S/C23H26N2O2.ClH/c26-23(27-21-16-24-13-10-18(21)11-14-24)25-15-12-17-6-4-5-9-20(17)22(25)19-7-2-1-3-8-19;/h1-9,18,21-22H,10-16H2;1H/t21-,22-;/m0./s1
    Synonyms
    2(1H)-Isoquinolinecarboxylic acid, 3,4-dihydro-1-phenyl-, (3R)-1-azabicyclo[2.2.2]oct-3-yl ester, hydrochloride (1:1)...
  3. Solifenacin (YM905)
    CAS: 242478-37-1 PubChem CID: 154059 Formula: C23H26N2O2 Molecular Weight: 362.48
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: S413250
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    IUPAC Name
    [(3R)-1-azabicyclo[2.2.2]octan-3-yl] (1S)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate
    SMILES
    C1CN2CCC1C(C2)OC(=O)N3CCC4=CC=CC=C4C3C5=CC=CC=C5
    InChIKey
    FBOUYBDGKBSUES-VXKWHMMOSA-N
    InChI
    1S/C23H26N2O2/c26-23(27-21-16-24-13-10-18(21)11-14-24)25-15-12-17-6-4-5-9-20(17)22(25)19-7-2-1-3-8-19/h1-9,18,21-22H,10-16H2/t21-,22-/m0/s1
    Synonyms
    solifenacine | A16947 | Solifenacin (INN) | SCHEMBL9971260 | Solifenacina | (3R)-1-azabicyclo[2.2.2]octan-3-yl (1S)-1...
  4. Solifenacin (YM905)
    CAS: 242478-37-1 PubChem CID: 154059 Formula: C23H26N2O2 Molecular Weight: 362.48
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO
    In Stock Item #: S422809
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    Technical Identifiers
    IUPAC Name
    [(3R)-1-azabicyclo[2.2.2]octan-3-yl] (1S)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate
    SMILES
    C1CN2CCC1C(C2)OC(=O)N3CCC4=CC=CC=C4C3C5=CC=CC=C5
    InChIKey
    FBOUYBDGKBSUES-VXKWHMMOSA-N
    InChI
    1S/C23H26N2O2/c26-23(27-21-16-24-13-10-18(21)11-14-24)25-15-12-17-6-4-5-9-20(17)22(25)19-7-2-1-3-8-19/h1-9,18,21-22H,10-16H2/t21-,22-/m0/s1
    Synonyms
    solifenacine | A16947 | Solifenacin (INN) | SCHEMBL9971260 | Solifenacina | (3R)-1-azabicyclo[2.2.2]octan-3-yl (1S)-1...
  5. NVP-CGM097
    CAS: 1313363-54-0 Formula: C38H47ClN4O4 Molecular Weight: 659.26
    10mM in DMSO
    In Stock Item #: N421212
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    Technical Identifiers
    IUPAC Name
    (1S)-1-(4-chlorophenyl)-6-methoxy-2-[4-[methyl-[[4-(4-methyl-3-oxopiperazin-1-yl)cyclohexyl]methyl]amino]phenyl]-7-propan-2-yloxy-1,4-dihydroisoquinolshow more
    SMILES
    CC(C)OC1=C(C=C2CC(=O)N(C(C2=C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)N(C)CC5CCC(CC5)N6CCN(C(=O)C6)C)OC
    InChIKey
    CLRSLRWKONPSRQ-CPOWQTMSSA-N
    InChI
    1S/C38H47ClN4O4/c1-25(2)47-35-22-33-28(20-34(35)46-5)21-36(44)43(38(33)27-8-10-29(39)11-9-27)32-16-14-30(15-17-32)41(4)23-26-6-12-31(13-7-26)42-19-18-show more
    Synonyms
    AKOS030526402 | BP-10652 | NSC783015 | NSC-783015 | SCHEMBL2391196 | CCG-270337 | Uridine pyrophosphate a-delta-galac...
  6. NVP-CGM097
    CAS: 1313363-54-0 Formula: C38H47ClN4O4 Molecular Weight: 659.26
    In Stock Item #: N413861
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    Technical Identifiers
    IUPAC Name
    (1S)-1-(4-chlorophenyl)-6-methoxy-2-[4-[methyl-[[4-(4-methyl-3-oxopiperazin-1-yl)cyclohexyl]methyl]amino]phenyl]-7-propan-2-yloxy-1,4-dihydroisoquinolshow more
    SMILES
    CC(C)OC1=C(C=C2CC(=O)N(C(C2=C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)N(C)CC5CCC(CC5)N6CCN(C(=O)C6)C)OC
    InChIKey
    CLRSLRWKONPSRQ-CPOWQTMSSA-N
    InChI
    1S/C38H47ClN4O4/c1-25(2)47-35-22-33-28(20-34(35)46-5)21-36(44)43(38(33)27-8-10-29(39)11-9-27)32-16-14-30(15-17-32)41(4)23-26-6-12-31(13-7-26)42-19-18-show more
    Synonyms
    AKOS030526402 | BP-10652 | NSC783015 | NSC-783015 | SCHEMBL2391196 | CCG-270337 | Uridine pyrophosphate a-delta-galac...
  7. 1-Phenyl-1,2-dihydroisoquinolin-3(4H)-one
    CAS: 17507-05-0 EC Number: 634-000-2 PubChem CID: 28576 Formula: C15H13NO Molecular Weight: 223.27
    Solid ≥97%
    Out of Stock Item #: P191557
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    Technical Identifiers
    IUPAC Name
    1-phenyl-2,4-dihydro-1H-isoquinolin-3-one
    SMILES
    C1C2=CC=CC=C2C(NC1=O)C3=CC=CC=C3
    InChIKey
    IAOCKKZVKNCZPK-UHFFFAOYSA-N
    InChI
    1S/C15H13NO/c17-14-10-12-8-4-5-9-13(12)15(16-14)11-6-2-1-3-7-11/h1-9,15H,10H2,(H,16,17)
  8. 1-Phenyl-1,2,3,4-tetrahydroisoquinoline
    CAS: 22990-19-8 PubChem CID: 100137 Formula: C15H15N Molecular Weight: 209.29
    In Stock Item #: P160805
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    Technical Identifiers
    IUPAC Name
    1-phenyl-1,2,3,4-tetrahydroisoquinoline
    SMILES
    C1CNC(C2=CC=CC=C21)C3=CC=CC=C3
    InChIKey
    PRTRSEDVLBBFJZ-UHFFFAOYSA-N
    InChI
    1S/C15H15N/c1-2-7-13(8-3-1)15-14-9-5-4-6-12(14)10-11-16-15/h1-9,15-16H,10-11H2
    Synonyms
    PD119414 | 1-phenyl-1,2,3,4-tetrahydro-isoquinoline, AldrichCPR | MFCD02179241 | NSC338399 | NSC-338399 | Q-101004 | ...
  9. (1R)-1-Phenyl-1,2,3,4-tetrahydroisoquinoline
    CAS: 180272-45-1 PubChem CID: 1382088 Formula: C15H15N Molecular Weight: 209.29
    In Stock Item #: R191652
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    Technical Identifiers
    IUPAC Name
    (1R)-1-phenyl-1,2,3,4-tetrahydroisoquinoline
    SMILES
    C1CNC(C2=CC=CC=C21)C3=CC=CC=C3
    InChIKey
    PRTRSEDVLBBFJZ-OAHLLOKOSA-N
    InChI
    1S/C15H15N/c1-2-7-13(8-3-1)15-14-9-5-4-6-12(14)10-11-16-15/h1-9,15-16H,10-11H2/t15-/m1/s1
    Synonyms
    Z1509142487 | PD119413 | Isoquinoline, 1,2,3,4-tetrahydro-1-phenyl-, (1R)- | AKOS016843427 | MFCD11858641 | SCHEMBL16...
  10. (S)-1-Phenyl-1,2,3,4-tetrahydroisoquinoline
    CAS: 118864-75-8 PubChem CID: 1382087 Formula: C15H15N Molecular Weight: 209.29
    In Stock Item #: S161031
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    Technical Identifiers
    IUPAC Name
    (1S)-1-phenyl-1,2,3,4-tetrahydroisoquinoline
    SMILES
    C1CNC(C2=CC=CC=C21)C3=CC=CC=C3
    InChIKey
    PRTRSEDVLBBFJZ-HNNXBMFYSA-N
    InChI
    1S/C15H15N/c1-2-7-13(8-3-1)15-14-9-5-4-6-12(14)10-11-16-15/h1-9,15-16H,10-11H2/t15-/m0/s1
    Synonyms
    PRTRSEDVLBBFJZ-HNNXBMFYSA-N | N5NZ4W5RGQ | Q-101005 | (S)-1,2,3,4-TETRAHYDRO-1-PHENYLISOQUINOLINE | 1(S)-phenyl-1,2,3...
  11. TC-I 2000
    CAS: 1159996-20-9 PubChem CID: 57326210 Formula: C23H18F4N2O Molecular Weight: 414.4
    In Stock Item #: T287244
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    Technical Identifiers
    IUPAC Name
    N-(4-fluorophenyl)-1-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
    SMILES
    C1CN(C(C2=CC=CC=C21)C3=CC=C(C=C3)C(F)(F)F)C(=O)NC4=CC=C(C=C4)F
    InChIKey
    ADCDUDFEGFKKQH-UHFFFAOYSA-N
    InChI
    1S/C23H18F4N2O/c24-18-9-11-19(12-10-18)28-22(30)29-14-13-15-3-1-2-4-20(15)21(29)16-5-7-17(8-6-16)23(25,26)27/h1-12,21H,13-14H2,(H,28,30)
    Synonyms
    N-(4-Fluorophenyl)-3,4-dihydro-1-[4-(trifluoromethyl)phenyl]-2(1H)-isoquinolinecarboxamide | N-(4-fluorophenyl)-1-(4-...
  12. Solifenacin succinate
    CAS: 242478-38-2 PubChem CID: 216457 Formula: C23H26N2O·C4H6O4 Molecular Weight: 480.55
    In Stock Item #: S129952
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    Technical Identifiers
    IUPAC Name
    [(3R)-1-azabicyclo[2.2.2]octan-3-yl] (1S)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate;butanedioic acid
    SMILES
    C1CN2CCC1C(C2)OC(=O)N3CCC4=CC=CC=C4C3C5=CC=CC=C5.C(CC(=O)O)C(=O)O
    InChIKey
    RXZMMZZRUPYENV-VROPFNGYSA-N
    InChI
    1S/C23H26N2O2.C4H6O4/c26-23(27-21-16-24-13-10-18(21)11-14-24)25-15-12-17-6-4-5-9-20(17)22(25)19-7-2-1-3-8-19;5-3(6)1-2-4(7)8/h1-9,18,21-22H,10-16H2;1-show more
    Synonyms
    MLS006010416 | s3048 | Vesicare (TN) | Solifenacin succinate [USAN] | (3R)-Quinuclidin-3-yl (1S)-1-phenyl-3,4-dihydro...
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