(1R,3s,5S)-3-(3-异丙基-5-甲基-4H-1,2,4-三唑-4-基)-8-氮杂双环[3.2.1]辛烷

CAS号
423165-07-5
CCD编号
CCD01960271
分子式
C13 H22 N4
分子量
234.345

基本信息

产品名称: (1R,3s,5S)-3-(3-异丙基-5-甲基-4H-1,2,4-三唑-4-基)-8-氮杂双环[3.2.1]辛烷
CAS: 423165-07-5
中文同义词: 5-氯-1,2-苯并异噻唑-3(2H)-酮 ; (1R,3s,5S)-3-(3-异丙基-5-甲基-4H-1,2,4-三唑-4-基)-8-氮杂双环[3.2.1]辛烷
英文同义词: (1R,3R,5S)-3-(3-ISOPROPYL-5-METHYL-[1,2,4]TRIAZOL-4-YL)-8-AZA-BICYCLO[3.2.1]OCTANE ; 3-(3-ISOPROPYL-5-METHYL-4H-1,2,4-TRIAZOL-4-YL)-3-EXO-8-AZABICYCLO[3.2.1]OCTANE ; 8-AZABICYCLO[3.2.1]OCTANE, 3-[3-METHYL-5-(1-METHYLETHYL)-4H-1,2,4-TRIAZOL-4-YL]-, (3-EXO)- ; (3-EXO)-3-(3-ISOPROPYL-5-METHYL-4H-1,2,4-TRIAZOL-4-YL)-8-AZABICYCLO[3.2.1]OCTANE ; (3-EXO)-3-[3-METHYL-5-(PROP-2-YL)-4H-1,2,4-TRIAZOL-4-YL]-8-AZABICYCLO[3.2.1]OCTANE ; 4-[(3-EXO)-8-AZABICYCLO[3.2.1]OCT-3-YL]-3-ISOPROPYL-5-METHYL-4H-1,2,4-TRIAZOLE ; DES[1-(4,4-DIFLUOROCYCLOHEXANECARBOXAMIDO)-1-PHENYLPROPYL] MARAVIROC ; (1R,3S,5S)-3-(3-ISOPROPYL-5-METHYL-4H-1,2,4-TRIAZOL-4-YL)-8-AZABICYCLO[3.2.1]OCTANE ; (3-EXO)-3-(3-ISOPROPYL-5-METHYL-[1,2,4]TRIAZOL-4-YL)-8-AZA-BICYCLO[3.2.1]OCTANE
MDL号: MFCD12912695
氢键受体数量: 4
氢键供体数量: 1
Smile: Cc1nnc(n1[C@H]2C[C@@H]3CC[C@H](C2)N3)C(C)C
InChi: InChI=1S/C13H22N4/c1-8(2)13-16-15-9(3)17(13)12-6-10-4-5-11(7-12)14-10/h8,10-12,14H,4-7H2,1-3H3/t10-,11+,12-
InChiKey: InChIKey=CEIRCCADSFHOQD-ZSBIGDGJSA-N

性质

注解: AVAILABILITY: 2-3 WEEKS
TSCA: FALSE

安全信息

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