423165-13-3
中文名称
8-苄基-3-外型-(5-异丙基-3-甲基-4H-1,2,4-三唑-4-基)-8-氮杂双环[3.2.1]辛烷
英文名称
8-BENZYL-3-EXO-(3-ISOPROPYL-5-METHYL-4H-1,2,4-TRIAZOL-4-YL)-8-AZABICYCLO[3.2.1]OCTANE
CAS
423165-13-3
分子式
C20H28N4
分子量
324.46
MOL 文件
423165-13-3.mol
423165-13-3 结构式
基本信息
中文别名
3-[3-甲基-5-异丙基-4H-1,2,4-三氮唑]-8-苄基-8-氮杂双环[3,2,1]辛烷8-苄基-3-外型-(5-异丙基-3-甲基-4H-1,2,4-三唑-4-基)-8-氮杂双环[3.2.1]辛烷
英文别名
Maraviroc interMediate(Tropine aMine )-8-Benzyl-3-(3-isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)
8-Benzyl-3-exo-(5-isopropyl-3-methyl-4H-1,2,4-triazol-4-yl)-...
8-benzyl-3-(3-isopropyl-5-Methyl-4H-1,2,4-triazol-4-yl)-8-aza-bicyclo[3.2.1]octane
8-BENZYL-3-EXO-(3-ISOPROPYL-5-METHYL-4H-1,2,4-TRIAZOL-4-YL)-8-AZABICYCLO[3.2.1]OCTANE
exo-8-Benzyl-3-(3-isopropyl-5-Methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
8-Benzyl-3-exo-(5-isopropyl-3-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
(3-exo)-8-Benzyl-(5-isopropyl-3-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
exo-8-benzyl-3-[3-methyl-5-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octane
(1R,3s,5S)-8-Benzyl-3-(3-isopropyl-5-Methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
所属类别
医药中间体：原料药中间体物理化学性质
熔点149 ºC
沸点481.5±55.0 °C(Predicted)
密度1.20
储存条件Sealed in dry,2-8°C
溶解度soluble in Chloroform, Dichloromethane
酸度系数(pKa)9.71±0.40(Predicted)
形态固体
颜色棕色
InChIInChI=1/C20H28N4/c1-14(2)20-22-21-15(3)24(20)19-11-17-9-10-18(12-19)23(17)13-16-7-5-4-6-8-16/h4-8,14,17-19H,9-13H2,1-3H3/t17-,18+,19-
InChIKeyYHGHRIAZABSSGB-REPLKXPHNA-N
SMILESC1C[C@]2([H])C[C@@H](N3C(C(C)C)=NN=C3C)C[C@@]1([H])N2CC1C=CC=CC=1 |&1:2,5,16,r|
