3-(3,4-二氟苯甲酰基)-1,2,3,6-四氢-1,1-二甲基氮杂卓[4,5-b]吲哚-5-甲酸 1-甲基乙基酯

CAS号
629664-81-9
CCD编号
CCD01996959
分子式
C25 H24 F2 N2 O3
分子量
438.472

基本信息

产品名称: 3-(3,4-二氟苯甲酰基)-1,2,3,6-四氢-1,1-二甲基氮杂卓[4,5-b]吲哚-5-甲酸 1-甲基乙基酯
CAS: 629664-81-9
中文同义词: 3-(3,4-二氟苯甲酰基)-1,2,3,6-四氢-1,1-二甲基氮杂卓[4,5-b]吲哚-5-甲酸 1-甲基乙基酯
英文同义词: XL 335 ; TUROFEXORATE ISOPROPYL ; 3-(3,4-DIFLUOROBENZOYL)-1,2,3,6-TETRAHYDRO-1,1-DIMETHYL-AZEPINO[4,5-B]INDOLE-5-CARBOXYLIC ACID 1-METHYLETHYL ESTER ; PROPAN-2-YL 3-[(3,4-DIFLUOROPHENYL)CARBONYL]-1,1-DIMETHYL-1H,2H,3H,6H-AZEPINO[4,5-B]INDOLE-5-CARBOXYLATE ; XL335 ; FXR 450 ; WAY-362450 ; AZEPINO[4,5-B]INDOLE-5-CARBOXYLIC ACID, 3-(3,4-DIFLUOROBENZOYL)-1,2,3,6-TETRAHYDRO-1,1-DIMETHYL-, 1-METHYLETHYL ESTER ; ISOPROPYL 3-(3,4-DIFLUOROBENZOYL)-1,1-DIMETHYL-1,2,3,6-TETRAHYDROAZEPINO[4,5-B]INDOLE-5-CARBOXYLATE
MDL号: MFCD13181507
氢键受体数量: 5
氢键供体数量: 1
Smile: CC(C)OC(=O)C1=CN(CC(c2c1[nH]c3c2cccc3)(C)C)C(=O)c4ccc(c(c4)F)F
InChi: InChI=1S/C25H24F2N2O3/c1-14(2)32-24(31)17-12-29(23(30)15-9-10-18(26)19(27)11-15)13-25(3,4)21-16-7-5-6-8-20(16)28-22(17)21/h5-12,14,28H,13H2,1-4H3
InChiKey: InChIKey=INASOKQDNHHMRE-UHFFFAOYSA-N

性质

安全信息

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