细胞色素P450 - 代谢酶/蛋白酶 - 按“信号通路”分类 - 小分子和化合物库

收藏夹比较
APD668
- ≥96%
CAS号: 832714-46-2

分子式: C₂₁H₂₄FN₅O₅S 分子量: 477.51

IUPAC Name: propan-2-yl 4-[1-(2-fluoro-4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidine-1-carboxylate

SMILES: CC(C)OC(=O)N1CCC(CC1)OC2=NC=NC3=C2C=NN3C4=C(C=C(C=C4)S(=O)(=O)C)F

InChIKey: XTRUQJBVQBUKSQ-UHFFFAOYSA-N

InChI: 1S/C21H24FN5O5S/c1-13(2)31-21(28)26-8-6-14(7-9-26)32-20-16-11-25-27(19(16)23-12-24-20)18-5-4-15(10-17(18)22)33(3,29)30/h4-5,10-14H,6-9H2,1-3H3
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收藏夹比较
APD668
- 10mM in DMSO
CAS号: 832714-46-2

分子式: C₂₁H₂₄FN₅O₅S 分子量: 477.51

IUPAC Name: propan-2-yl 4-[1-(2-fluoro-4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidine-1-carboxylate

SMILES: CC(C)OC(=O)N1CCC(CC1)OC2=NC=NC3=C2C=NN3C4=C(C=C(C=C4)S(=O)(=O)C)F

InChIKey: XTRUQJBVQBUKSQ-UHFFFAOYSA-N

InChI: 1S/C21H24FN5O5S/c1-13(2)31-21(28)26-8-6-14(7-9-26)32-20-16-11-25-27(19(16)23-12-24-20)18-5-4-15(10-17(18)22)33(3,29)30/h4-5,10-14H,6-9H2,1-3H3
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