5-(((2R,3S)-2-((R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL)MORPHOLINO)METHYL)-1H-PYRAZOL-3(2H)-ONE

CAS号
170729-80-3
CCD编号
CCD07406051
分子式
C24 H22 F7 N3 O3
分子量
533.442

基本信息

产品名称: 5-(((2R,3S)-2-((R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL)MORPHOLINO)METHYL)-1H-PYRAZOL-3(2H)-ONE
CAS: 170729-80-3
英文同义词: 5-(((2R,3S)-2-((R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL)MORPHOLINO)METHYL)-1H-PYRAZOL-3(2H)-ONE
MDL号: MFCD22460466
氢键受体数量: 6
氢键供体数量: 2
Smile: C[C@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)O[C@@H]2[C@@H](N(CCO2)Cc3cc(=O)[nH][nH]3)c4ccc(cc4)F
InChi: InChI=1S/C24H22F7N3O3/c1-13(15-8-16(23(26,27)28)10-17(9-15)24(29,30)31)37-22-21(14-2-4-18(25)5-3-14)34(6-7-36-22)12-19-11-20(35)33-32-19/h2-5,8-11,13,21-22H,6-7,12H2,1H3,(H2,32,33,35)/t13-,21+,22-/m1/s1
InChiKey: InChIKey=JOHNUEUKZPPJET-BGUDKVOASA-N

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