小分子和化合物库

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显示第112个,产品总数62

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  1. 逆转素
      规格或纯度 :
    • ≥97%(HPLC)
    CAS号 : 656820-32-5        Compound CID : 210332
    分子式: C21H27N7O        分子量: 393.49
    IUPAC Name: 6-N-cyclohexyl-2-N-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine
    SMILES: C1CCC(CC1)NC2=NC(=NC3=C2NC=N3)NC4=CC=C(C=C4)N5CCOCC5
    InChIKey: ZFLJHSQHILSNCM-UHFFFAOYSA-N
    InChI: InChI=1S/C21H27N7O/c1-2-4-15(5-3-1)24-20-18-19(23-14-22-18)26-21(27-20)25-16-6-8-17(9-7-16)28-10-12-29-13-11-28/h6-9,14-15H,1-5,10-13H2,(H3,22,23,24,25,26,27)
  2. CYC116,Aurora A/B抑制剂
      规格或纯度 :
    • ≥98%
    CAS号 : 693228-63-6        Compound CID : 6420138
    分子式: C18H20N6OS        分子量: 368.46
    IUPAC Name: 4-methyl-5-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]-1,3-thiazol-2-amine
    SMILES: CC1=C(SC(=N1)N)C2=NC(=NC=C2)NC3=CC=C(C=C3)N4CCOCC4
    InChIKey: GPSZYOIFQZPWEJ-UHFFFAOYSA-N
    InChI: InChI=1S/C18H20N6OS/c1-12-16(26-17(19)21-12)15-6-7-20-18(23-15)22-13-2-4-14(5-3-13)24-8-10-25-11-9-24/h2-7H,8-11H2,1H3,(H2,19,21)(H,20,22,23)
  3. DB07268,JNK1抑制剂
      规格或纯度 :
    • ≥98%
    CAS号 : 929007-72-7        Compound CID : 16058637
    分子式: C17H15N5O2        分子量: 321.33
    IUPAC Name: 2-[[2-(3-hydroxyanilino)pyrimidin-4-yl]amino]benzamide
    SMILES: C1=CC=C(C(=C1)C(=O)N)NC2=NC(=NC=C2)NC3=CC(=CC=C3)O
    InChIKey: QHPKKGUGRGRSGA-UHFFFAOYSA-N
    InChI: InChI=1S/C17H15N5O2/c18-16(24)13-6-1-2-7-14(13)21-15-8-9-19-17(22-15)20-11-4-3-5-12(23)10-11/h1-10,23H,(H2,18,24)(H2,19,20,21,22)
  4. JNK-IN-7
      规格或纯度 :
    • ≥98%
    CAS号 : 1408064-71-0        Compound CID : 57340685
    分子式: C28H27N7O2        分子量: 493.56
    IUPAC Name: 3-[[(E)-4-(dimethylamino)but-2-enoyl]amino]-N-[4-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide
    SMILES: CN(C)CC=CC(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CN=CC=C4
    InChIKey: RADRIIWGHYFWPP-WEVVVXLNSA-N
    InChI: InChI=1S/C28H27N7O2/c1-35(2)17-5-9-26(36)31-24-8-3-6-20(18-24)27(37)32-22-10-12-23(13-11-22)33-28-30-16-14-25(34-28)21-7-4-15-29-19-21/h3-16,18-19H,17H2,1-2H3,(H,31,36)(H,32,37)(H,30,33,34)/b9-5+
  5. SR 3576,JNK3抑制剂
      规格或纯度 :
    • ≥98%
    CAS号 : 1164153-22-3        Compound CID : 70702008
    分子式: C27H27N5O5        分子量: 501.54
    IUPAC Name: 3-[4-[(3-methylphenyl)carbamoylamino]pyrazol-1-yl]-N-(3,4,5-trimethoxyphenyl)benzamide
    SMILES: CC1=CC(=CC=C1)NC(=O)NC2=CN(N=C2)C3=CC=CC(=C3)C(=O)NC4=CC(=C(C(=C4)OC)OC)OC
    InChIKey: MTFAYLZZDJGFGV-UHFFFAOYSA-N
    InChI: InChI=1S/C27H27N5O5/c1-17-7-5-9-19(11-17)30-27(34)31-21-15-28-32(16-21)22-10-6-8-18(12-22)26(33)29-20-13-23(35-2)25(37-4)24(14-20)36-3/h5-16H,1-4H3,(H,29,33)(H2,30,31,34)
  6. CC-671
      规格或纯度 :
    • ≥98%
    CAS号 : 1618658-88-0        Compound CID : 117881270
    分子式: C28H28N6O4        分子量: 512.56
    IUPAC Name: 4-[[4-cyclopentyloxy-5-(2-methyl-1,3-benzoxazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-3-methoxy-N-methylbenzamide
    SMILES: CC1=NC2=C(O1)C=C(C=C2)C3=CNC4=C3C(=NC(=N4)NC5=C(C=C(C=C5)C(=O)NC)OC)OC6CCCC6
    InChIKey: CWJLAVRXVFHDSJ-UHFFFAOYSA-N
    InChI: InChI=1S/C28H28N6O4/c1-15-31-21-10-8-16(12-23(21)37-15)19-14-30-25-24(19)27(38-18-6-4-5-7-18)34-28(33-25)32-20-11-9-17(26(35)29-2)13-22(20)36-3/h8-14,18H,4-7H2,1-3H3,(H,29,35)(H2,30,32,33,34)
  7. BAY 1217389
      规格或纯度 :
    • ≥99%
    CAS号 : 1554458-53-5        Compound CID : 78320750
    分子式: C27H24F5N5O3        分子量: 561.5
    IUPAC Name: N-cyclopropyl-4-[6-(2,3-difluoro-4-methoxyphenoxy)-8-(3,3,3-trifluoropropylamino)imidazo[1,2-b]pyridazin-3-yl]-2-methylbenzamide
    SMILES: CC1=C(C=CC(=C1)C2=CN=C3N2N=C(C=C3NCCC(F)(F)F)OC4=C(C(=C(C=C4)OC)F)F)C(=O)NC5CC5
    InChIKey: WNEILUNVMHVMPH-UHFFFAOYSA-N
    InChI: InChI=1S/C27H24F5N5O3/c1-14-11-15(3-6-17(14)26(38)35-16-4-5-16)19-13-34-25-18(33-10-9-27(30,31)32)12-22(36-37(19)25)40-21-8-7-20(39-2)23(28)24(21)29/h3,6-8,11-13,16,33H,4-5,9-10H2,1-2H3,(H,35,38)
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