小分子和化合物库

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显示第112个,产品总数59

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  1. UCB 35625,CCR1和CCR3拮抗剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 202796-42-7        Compound CID : 6918496
    分子式: C30H37Cl2IN2O2        分子量: 655.44
    IUPAC Name: 2,7-dichloro-N-[1-[[(1E)-cycloocten-1-yl]methyl]-1-ethylpiperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide;iodide
    SMILES: CC[N+]1(CCC(CC1)NC(=O)C2C3=C(C=CC(=C3)Cl)OC4=C2C=C(C=C4)Cl)CC5=CCCCCCC5.[I-]
    InChIKey: FOAFBMYSXIGAOX-LQGGPMKRSA-N
    InChI: InChI=1S/C30H36Cl2N2O2.HI/c1-2-34(20-21-8-6-4-3-5-7-9-21)16-14-24(15-17-34)33-30(35)29-25-18-22(31)10-12-27(25)36-28-13-11-23(32)19-26(28)29;/h8,10-13,18-19,24,29H,2-7,9,14-17,20H2,1H3;1H/b21-8+;
  2. J 113863,CCR1趋化因子受体拮抗剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 202796-41-6        Compound CID : 6918496
    分子式: C30H37Cl2IN2O2        分子量: 655.44
    IUPAC Name: 2,7-dichloro-N-[1-[[(1E)-cycloocten-1-yl]methyl]-1-ethylpiperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide;iodide
    SMILES: CC[N+]1(CCC(CC1)NC(=O)C2C3=C(C=CC(=C3)Cl)OC4=C2C=C(C=C4)Cl)CC5=CCCCCCC5.[I-]
    InChIKey: FOAFBMYSXIGAOX-LQGGPMKRSA-N
    InChI: InChI=1S/C30H36Cl2N2O2.HI/c1-2-34(20-21-8-6-4-3-5-7-9-21)16-14-24(15-17-34)33-30(35)29-25-18-22(31)10-12-27(25)36-28-13-11-23(32)19-26(28)29;/h8,10-13,18-19,24,29H,2-7,9,14-17,20H2,1H3;1H/b21-8+;
  3. J 113863
      规格或纯度 :
    • ≥98%
    CAS号 : 353791-85-2        Compound CID : 6918496
    分子式: C30H37Cl2IN2O2        分子量: 655.44
    IUPAC Name: 2,7-dichloro-N-[1-[[(1E)-cycloocten-1-yl]methyl]-1-ethylpiperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide;iodide
    SMILES: CC[N+]1(CCC(CC1)NC(=O)C2C3=C(C=CC(=C3)Cl)OC4=C2C=C(C=C4)Cl)CC5=CCCCCCC5.[I-]
    InChIKey: FOAFBMYSXIGAOX-LQGGPMKRSA-N
    InChI: InChI=1S/C30H36Cl2N2O2.HI/c1-2-34(20-21-8-6-4-3-5-7-9-21)16-14-24(15-17-34)33-30(35)29-25-18-22(31)10-12-27(25)36-28-13-11-23(32)19-26(28)29;/h8,10-13,18-19,24,29H,2-7,9,14-17,20H2,1H3;1H/b21-8+;
  4. AZ 191
    CAS号 : 1594092-37-1        Compound CID : 72716071
    分子式: C24H27N7O        分子量: 429.52
    IUPAC Name: N-[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]-4-(1-methylpyrrolo[2,3-c]pyridin-3-yl)pyrimidin-2-amine
    SMILES: CN1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=CC(=N3)C4=CN(C5=C4C=CN=C5)C)OC
    InChIKey: ZYVXTMKTGDARKR-UHFFFAOYSA-N
    InChI: InChI=1S/C24H27N7O/c1-29-10-12-31(13-11-29)17-4-5-21(23(14-17)32-3)28-24-26-9-7-20(27-24)19-16-30(2)22-15-25-8-6-18(19)22/h4-9,14-16H,10-13H2,1-3H3,(H,26,27,28)
  5. A-674563
    CAS号 : 552325-73-2        Compound CID : 11314340
    分子式: C22H22N4O        分子量: 358.44
    IUPAC Name: (2S)-1-[5-(3-methyl-2H-indazol-5-yl)pyridin-3-yl]oxy-3-phenylpropan-2-amine
    SMILES: CC1=C2C=C(C=CC2=NN1)C3=CC(=CN=C3)OCC(CC4=CC=CC=C4)N
    InChIKey: BPNUQXPIQBZCMR-IBGZPJMESA-N
    InChI: InChI=1S/C22H22N4O/c1-15-21-11-17(7-8-22(21)26-25-15)18-10-20(13-24-12-18)27-14-19(23)9-16-5-3-2-4-6-16/h2-8,10-13,19H,9,14,23H2,1H3,(H,25,26)/t19-/m0/s1
  6. EHT 5372
      规格或纯度 :
    • ≥95%
    CAS号 : 1425945-63-6        Compound CID : 71529610
    分子式: C17H11Cl2N5OS        分子量: 404.27
    IUPAC Name: methyl 9-(2,4-dichloroanilino)-[1,3]thiazolo[5,4-f]quinazoline-2-carboximidate
    SMILES: COC(=N)C1=NC2=C(S1)C3=C(C=C2)N=CN=C3NC4=C(C=C(C=C4)Cl)Cl
    InChIKey: QSGKPYRFWJINEH-UHFFFAOYSA-N
    InChI: InChI=1S/C17H11Cl2N5OS/c1-25-15(20)17-24-12-5-4-11-13(14(12)26-17)16(22-7-21-11)23-10-3-2-8(18)6-9(10)19/h2-7,20H,1H3,(H,21,22,23)
  7. EHT 1610
      规格或纯度 :
    • ≥98%
    CAS号 : 1425945-60-3        Compound CID : 71529602
    分子式: C18H14FN5O2S        分子量: 383.40
    IUPAC Name: methyl 9-(2-fluoro-4-methoxyanilino)-[1,3]thiazolo[5,4-f]quinazoline-2-carboximidate
    SMILES: COC1=CC(=C(C=C1)NC2=NC=NC3=C2C4=C(C=C3)N=C(S4)C(=N)OC)F
    InChIKey: RYBNARZBIXTFJS-UHFFFAOYSA-N
    InChI: InChI=1S/C18H14FN5O2S/c1-25-9-3-4-11(10(19)7-9)23-17-14-12(21-8-22-17)5-6-13-15(14)27-18(24-13)16(20)26-2/h3-8,20H,1-2H3,(H,21,22,23)
  8. A-674563
    CAS号 : 552325-73-2        Compound CID : 11314340
    分子式: C22H22N4O        分子量: 358.44
    IUPAC Name: (2S)-1-[5-(3-methyl-2H-indazol-5-yl)pyridin-3-yl]oxy-3-phenylpropan-2-amine
    SMILES: CC1=C2C=C(C=CC2=NN1)C3=CC(=CN=C3)OCC(CC4=CC=CC=C4)N
    InChIKey: BPNUQXPIQBZCMR-IBGZPJMESA-N
    InChI: InChI=1S/C22H22N4O/c1-15-21-11-17(7-8-22(21)26-25-15)18-10-20(13-24-12-18)27-14-19(23)9-16-5-3-2-4-6-16/h2-8,10-13,19H,9,14,23H2,1H3,(H,25,26)/t19-/m0/s1
  9. PHA-767491,双重Cdc7和Cdk9激酶抑制剂
    CAS号 : 845714-00-3        Compound CID : 11715767
    分子式: C12H11N3O        分子量: 213.24
    IUPAC Name: 2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
    SMILES: C1CNC(=O)C2=C1NC(=C2)C3=CC=NC=C3
    InChIKey: DKXHSOUZPMHNIZ-UHFFFAOYSA-N
    InChI: InChI=1S/C12H11N3O/c16-12-9-7-11(8-1-4-13-5-2-8)15-10(9)3-6-14-12/h1-2,4-5,7,15H,3,6H2,(H,14,16)
  10. 星形孢菌素
    CAS号 : 62996-74-1        Compound CID : 44259
    分子式: C28H26N4O3        分子量: 466.53
    IUPAC Name: (2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one
    SMILES: CC12C(C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)NC)OC
    InChIKey: HKSZLNNOFSGOKW-FYTWVXJKSA-N
    InChI: InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1
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