1631164-25-4
中文名称
BAY 1214784
英文名称
Spiro[3H-indole-3,4'-[4H]thiopyran]-5-carboxamide, N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-2-cyclopropyl-1-[(4-fluorophenyl)sulfonyl]-1,2,2',3',5',6'-hexahydro-, 1',1'-dioxide, (2R)-
CAS
1631164-25-4
分子式
C29H26ClF4N3O5S2
分子量
672.11
MOL 文件
1631164-25-4.mol
1631164-25-4 结构式
基本信息
中文别名
化合物 BAY 1214784 英文别名
(R)-N-((3-chloro-5-(trifluoromethyl)pyridin-2-yl)methyl)-2-cyclopropyl-1-((4-fluorophenyl)sulfonyl)-(2R)-N-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl}-2-cyclopropyl-1-[(4-fluorophenyl)sulfonyl]-1,2,2',3',5',6'-hexahydrospiro[indole-3,4'-thiopyran]-5-carboxamide 1',1'-dioxide
Spiro[3H-indole-3,4'-[4H]thiopyran]-5-carboxamide, N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-2-cyclopropyl-1-[(4-fluorophenyl)sulfonyl]-1,2,2',3',5',6'-hexahydro-, 1',1'-dioxide, (2R)-
物理化学性质
密度1.60±0.1 g/cm3(Predicted)
储存条件2-8°C
溶解度DMSO: 2mg/mL, clear
酸度系数(pKa)12.47±0.40(Predicted)
形态powder
颜色white to beige
旋光度 (Optical Rotation)[α]/D 105 to 125°, c =0.5 in chloroform-d
InChIKeyPZGSYNNVPNLHQG-AREMUKBSSA-N
SMILESO=C(C1=CC2=C(N(S(=O)(C3=CC=C(F)C=C3)=O)[C@H](C4CC4)C2(CC5)CCS5(=O)=O)C=C1)NCC6=NC=C(C(F)(F)F)C=C6Cl