Benzazocines

Description:

Organic compounds containing the benzazocine ring system, which consists of a benzene ring bound to an azocine ring.

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  1. Ecteinascidin 770
    CAS: 114899-80-8 PubChem CID: 10952807
    Out of Stock Item #: E1030632
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    IUPAC Name
    [(1R,2R,3R,11S,12R,14R,26R)-12-cyano-5,6'-dihydroxy-6,7'-dimethoxy-7,21,30-trimethyl-27-oxospiro[17,19,28-trioxa-24-thia-13,30-diazaheptacyclo[12.9.6.show more
    SMILES
    CC1=CC2=C(C3C4C5C6=C(C(=C7C(=C6C(N4C(C(C2)N3C)C#N)COC(=O)C8(CS5)C9=CC(=C(C=C9CCN8)O)OC)OCO7)C)OC(=O)C)C(=C1OC)O
    InChIKey
    BGFXHQYUWCGGLL-QWIBJBKUSA-N
    InChI
    1S/C40H42N4O10S/c1-17-9-21-10-23-24(13-41)44-25-14-51-39(48)40(22-12-27(49-5)26(46)11-20(22)7-8-42-40)15-55-38(32(44)31(43(23)4)28(21)33(47)34(17)50-6show more
  2. Zalypsis
    CAS: 308359-57-1 PubChem CID: 16061448 Formula: C37H38F3N3O8 Molecular Weight: 709.7
    Out of Stock Item #: Z671130
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    IUPAC Name
    [(1R,2S,13R,15S,16S)-15,22-dihydroxy-21-methoxy-6,20,24-trimethyl-13-[[[(E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoyl]amino]methyl]-8,10-dioxa-14,24-dshow more
    SMILES
    CC1=CC2=C(C3C4CC5=C(C(=C6C(=C5C(N4C(C(C2)N3C)O)CNC(=O)C=CC7=CC(=CC=C7)C(F)(F)F)OCO6)C)OC(=O)C)C(=C1OC)O
    InChIKey
    VPAHZSUNBOYNQY-DLVGLDQCSA-N
    InChI
    1S/C37H38F3N3O8/c1-17-11-21-13-25-36(47)43-24(30(42(25)4)28(21)31(46)32(17)48-5)14-23-29(35-34(49-16-50-35)18(2)33(23)51-19(3)44)26(43)15-41-27(45)10-show more
    Synonyms
    Zalypsis | VPAHZSUNBOYNQY-DLVGLDQCSA-N | 2-Propenamide, N-(((6aS,7R,13S,14S,16R)-5-(acetyloxy)-6,6a,7,13,14,16-hexahy...
  3. Cenicriviroc Mesylate
    CAS: 497223-28-6 EC Number: 824-584-9 PubChem CID: 11285791 Formula: C42H56N4O7S2 Molecular Weight: 793.05
    Solid 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 #: C646535
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    Synonyms
    (-)-8-[4-(2-Butoxyethoxy)phenyl]-1-isobutyl-N-[4-[[(1-propyl-1H-imidazol-5-yl)methyl]sulfinyl]phenyl]-1,2,3,4-tetrahy...
  4. cenicriviroc
    CAS: 497223-25-3 Formula: C41H52N4O4S Molecular Weight: 696.95
    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 #: C424285
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    IUPAC Name
    (5E)-8-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-N-[4-[(S)-(3-propylimidazol-4-yl)methylsulfinyl]phenyl]-3,4-dihydro-2H-1-benzazocine-5-carboxamidshow more
    SMILES
    CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCCC(=C3)C(=O)NC4=CC=C(C=C4)S(=O)CC5=CN=CN5CCC)CC(C)C
    InChIKey
    PNDKCRDVVKJPKG-WHERJAGFSA-N
    InChI
    1S/C41H52N4O4S/c1-5-7-22-48-23-24-49-38-15-10-32(11-16-38)33-12-19-40-35(25-33)26-34(9-8-21-44(40)28-31(3)4)41(46)43-36-13-17-39(18-14-36)50(47)29-37-show more
    Synonyms
    s8512 | 15C116UA4Y | CENICRIVIROC [WHO-DD] | TAK 652 | 1-Benzazocine-5-carboxamide, 8-[4-(2-butoxyethoxy)phenyl]-1,2,...
  5. cenicriviroc
    CAS: 497223-25-3 Formula: C41H52N4O4S Molecular Weight: 696.95
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥97%
    In Stock Item #: C176619
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    IUPAC Name
    (5E)-8-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-N-[4-[(S)-(3-propylimidazol-4-yl)methylsulfinyl]phenyl]-3,4-dihydro-2H-1-benzazocine-5-carboxamidshow more
    SMILES
    CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCCC(=C3)C(=O)NC4=CC=C(C=C4)S(=O)CC5=CN=CN5CCC)CC(C)C
    InChIKey
    PNDKCRDVVKJPKG-WHERJAGFSA-N
    InChI
    1S/C41H52N4O4S/c1-5-7-22-48-23-24-49-38-15-10-32(11-16-38)33-12-19-40-35(25-33)26-34(9-8-21-44(40)28-31(3)4)41(46)43-36-13-17-39(18-14-36)50(47)29-37-show more
    Synonyms
    s8512 | 15C116UA4Y | CENICRIVIROC [WHO-DD] | TAK 652 | 1-Benzazocine-5-carboxamide, 8-[4-(2-butoxyethoxy)phenyl]-1,2,...
  6. Trabectedin
    CAS: 114899-77-3 PubChem CID: 108150 Formula: C39H43N3O11S Molecular Weight: 761.84
    Solid 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 #: T128049
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    Technical Identifiers
    IUPAC Name
    [(1R,2R,3R,11S,12S,14R,26R)-5,6',12-trihydroxy-6,7'-dimethoxy-7,21,30-trimethyl-27-oxospiro[17,19,28-trioxa-24-thia-13,30-diazaheptacyclo[12.9.6.13,11show more
    SMILES
    CC1=CC2=C(C3C4C5C6=C(C(=C7C(=C6C(N4C(C(C2)N3C)O)COC(=O)C8(CS5)C9=CC(=C(C=C9CCN8)O)OC)OCO7)C)OC(=O)C)C(=C1OC)O
    InChIKey
    PKVRCIRHQMSYJX-AIFWHQITSA-N
    InChI
    1S/C39H43N3O11S/c1-16-9-20-10-22-37(46)42-23-13-50-38(47)39(21-12-25(48-5)24(44)11-19(21)7-8-40-39)14-54-36(30(42)29(41(22)4)26(20)31(45)32(16)49-6)28show more
    Synonyms
    Ecteinascidin 743;ET-743 | F81329 | ID0YZQ2TCP | NSC-684766 | SCHEMBL12119916 | CAS-114899-77-3 | trabectedinum | L-T...
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