Pyrrolopyrimidines

Description:

Compounds containing a pyrrolopyrimidine moiety, which consists of a pyrrole ring fused to a pyrimidine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

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  1. 2-(2,2,3,3,3-Pentafluoropropoxy)-3-[4-(2,2,2-trifluoroethoxy)phenyl]-5,7-dihydro-3H-pyrrolo[2,3-d]pyrimidine-4,6-dione
    CAS: 1236767-85-3 Formula: C17H11F8N3O4 Molecular Weight: 473.270
    Out of Stock Item #: P972464
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    IUPAC Name
    2-(2,2,3,3,3-pentafluoropropoxy)-3-[4-(2,2,2-trifluoroethoxy)phenyl]-5,7-dihydropyrrolo[2,3-d]pyrimidine-4,6-dione
    SMILES
    C1C2=C(NC1=O)N=C(N(C2=O)C3=CC=C(C=C3)OCC(F)(F)F)OCC(C(F)(F)F)(F)F
    InChIKey
    NGUQGJZXDBRNOL-UHFFFAOYSA-N
    InChI
    1S/C17H11F8N3O4/c18-15(19,17(23,24)25)6-32-14-27-12-10(5-11(29)26-12)13(30)28(14)8-1-3-9(4-2-8)31-7-16(20,21)22/h1-4H,5-7H2,(H,26,29)
  2. N-Methyl-N-((3R,4R)-4-Methylpiperidin-3-yl)-7H-pyrrolo[2,3-d]pyriMidin-4-amine dihydrochloride
    CAS: 1260590-51-9 PubChem CID: 72206804 Formula: C13H19N5·HCl Molecular Weight: 281.78
    Solid ≥98.5%
    Out of Stock Item #: N768324
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    IUPAC Name
    N-methyl-N-[(3R,4R)-4-methylpiperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine;hydrochloride
    SMILES
    CC1CCNCC1N(C)C2=NC=NC3=C2C=CN3.Cl
    InChIKey
    CJRKOJYCZNKFRI-XQKZEKTMSA-N
    InChI
    1S/C13H19N5.ClH/c1-9-3-5-14-7-11(9)18(2)13-10-4-6-15-12(10)16-8-17-13;/h4,6,8-9,11,14H,3,5,7H2,1-2H3,(H,15,16,17);1H/t9-,11+;/m1./s1
  3. 2-Chloro-4-methoxy-7H-pyrrolo[2,3-d]pyrimidine
    CAS: 96022-77-4 PubChem CID: 29976038 Formula: C7H6ClN3O Molecular Weight: 183.6
    Out of Stock Item #: C731728
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    IUPAC Name
    2-chloro-4-methoxy-7H-pyrrolo[2,3-d]pyrimidine
    SMILES
    COC1=NC(=NC2=C1C=CN2)Cl
    InChIKey
    GFXPNNYTVBWDSO-UHFFFAOYSA-N
    InChI
    1S/C7H6ClN3O/c1-12-6-4-2-3-9-5(4)10-7(8)11-6/h2-3H,1H3,(H,9,10,11)
  4. (4-Chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methyl pivalate
    CAS: 1146629-75-5 PubChem CID: 57868847 Formula: C12H14ClN3O2 Molecular Weight: 267.71
    Out of Stock Item #: M734262
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    IUPAC Name
    (4-chloropyrrolo[2,3-d]pyrimidin-7-yl)methyl 2,2-dimethylpropanoate
    SMILES
    CC(C)(C)C(=O)OCN1C=CC2=C1N=CN=C2Cl
    InChIKey
    DTPDTZKIIYSQPO-UHFFFAOYSA-N
    InChI
    1S/C12H14ClN3O2/c1-12(2,3)11(17)18-7-16-5-4-8-9(13)14-6-15-10(8)16/h4-6H,7H2,1-3H3
  5. Ethyl 6-bromopyrrolo[1,2-c]pyrimidine-3-carboxylate
    CAS: 588720-12-1 PubChem CID: 22566071 Formula: C10H9BrN2O2 Molecular Weight: 269.1
    Out of Stock Item #: E730779
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    IUPAC Name
    ethyl 6-bromopyrrolo[1,2-c]pyrimidine-3-carboxylate
    SMILES
    CCOC(=O)C1=CC2=CC(=CN2C=N1)Br
    InChIKey
    RRKJEGMEYNSMNH-UHFFFAOYSA-N
    InChI
    1S/C10H9BrN2O2/c1-2-15-10(14)9-4-8-3-7(11)5-13(8)6-12-9/h3-6H,2H2,1H3
  6. 6,7-Dihydro-5H-pyrrolo[3,4-d]pyrimidine
    CAS: 53493-80-4 Formula: C6H7N3 Molecular Weight: 121.14
    Out of Stock Item #: D725284
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    Technical Identifiers
    IUPAC Name
    6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
    SMILES
    C1C2=CN=CN=C2CN1
    InChIKey
    NBXIOQTYZWAAEB-UHFFFAOYSA-N
    InChI
    1S/C6H7N3/c1-5-2-8-4-9-6(5)3-7-1/h2,4,7H,1,3H2
  7. 6,7-Dihydro-5H-pyrrolo[3,4-d]pyrimidinedihydrochloride
    CAS: 157327-51-0 PubChem CID: 44182365 Formula: C6H9Cl2N3 Molecular Weight: 194.06
    Out of Stock Item #: D732069
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    Technical Identifiers
    IUPAC Name
    6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine;dihydrochloride
    SMILES
    C1C2=CN=CN=C2CN1.Cl.Cl
    InChIKey
    VGQSNQPVXPPLEH-UHFFFAOYSA-N
    InChI
    1S/C6H7N3.2ClH/c1-5-2-8-4-9-6(5)3-7-1;;/h2,4,7H,1,3H2;2*1H
  8. 5-Iodo-7H-pyrrolo[2,3-d]pyrimidin-2-amine
    CAS: 1416354-36-3 PubChem CID: 70701096 Formula: C6H5IN4 Molecular Weight: 260.04
    Out of Stock Item #: I734847
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    Technical Identifiers
    IUPAC Name
    5-iodo-7H-pyrrolo[2,3-d]pyrimidin-2-amine
    SMILES
    C1=C(C2=CN=C(N=C2N1)N)I
    InChIKey
    VAQOHRRKRVCAIA-UHFFFAOYSA-N
    InChI
    1S/C6H5IN4/c7-4-2-9-5-3(4)1-10-6(8)11-5/h1-2H,(H3,8,9,10,11)
  9. 5-Chloro-7H-pyrrolo[2,3-d]pyrimidine
    CAS: 1041864-02-1 PubChem CID: 42609291 Formula: C6H4ClN3 Molecular Weight: 153.57
    Out of Stock Item #: C731900
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    Technical Identifiers
    IUPAC Name
    5-chloro-7H-pyrrolo[2,3-d]pyrimidine
    SMILES
    C1=C(C2=CN=CN=C2N1)Cl
    InChIKey
    LRBDMVYIUGZSKX-UHFFFAOYSA-N
    InChI
    1S/C6H4ClN3/c7-5-2-9-6-4(5)1-8-3-10-6/h1-3H,(H,8,9,10)
  10. 4,6-Dichloro-7H-pyrrolo[2,3-d]pyrimidine
    CAS: 97337-32-1 PubChem CID: 14431058 Formula: C6H3Cl2N3 Molecular Weight: 188.01
    Out of Stock Item #: D727943
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    Technical Identifiers
    IUPAC Name
    4,6-dichloro-7H-pyrrolo[2,3-d]pyrimidine
    SMILES
    C1=C(NC2=C1C(=NC=N2)Cl)Cl
    InChIKey
    CGTRULURZFVPIX-UHFFFAOYSA-N
    InChI
    1S/C6H3Cl2N3/c7-4-1-3-5(8)9-2-10-6(3)11-4/h1-2H,(H,9,10,11)
  11. 4-Chloro-7H-pyrrolo[2,3-d]pyrimidin-5-amine
    CAS: 1092352-49-2 PubChem CID: 21983844 Formula: C6H5ClN4 Molecular Weight: 168.58
    Out of Stock Item #: C730377
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    Technical Identifiers
    IUPAC Name
    4-chloro-7H-pyrrolo[2,3-d]pyrimidin-5-amine
    SMILES
    C1=C(C2=C(N1)N=CN=C2Cl)N
    InChIKey
    KAUCHHKKEDFVMC-UHFFFAOYSA-N
    InChI
    1S/C6H5ClN4/c7-5-4-3(8)1-9-6(4)11-2-10-5/h1-2H,8H2,(H,9,10,11)
  12. 4-Chloro-7-cyclopentyl-5-iodo-7H-pyrrolo[2,3-d]pyrimidine
    CAS: 213745-17-6 PubChem CID: 19597434 Formula: C11H11ClIN3 Molecular Weight: 347.58
    Out of Stock Item #: C729579
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    Technical Identifiers
    IUPAC Name
    4-chloro-7-cyclopentyl-5-iodopyrrolo[2,3-d]pyrimidine
    SMILES
    C1CCC(C1)N2C=C(C3=C2N=CN=C3Cl)I
    InChIKey
    SZBOWPMFRHBAES-UHFFFAOYSA-N
    InChI
    1S/C11H11ClIN3/c12-10-9-8(13)5-16(7-3-1-2-4-7)11(9)15-6-14-10/h5-7H,1-4H2
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