(S)-2-Amino-N-((1S,2S,4R)-7,7-dimethyl-1-(((4-(o-tolyl)piperazin-1-yl)sulfonyl)methyl)bicyclo[2.2.1]heptan-2-yl)-4-(methylsulfonyl)butanamide hydrochloride
(S)-2-Amino-N-((1S,2S,4R)-7,7-dimethyl-1-(((4-(o-tolyl)piperazin-1-yl)sulfonyl)methyl)bicyclo[2.2.1]heptan-2-yl)-4-(methylsulfonyl)butanamide hydrochloride · CAS 160312-62-9
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- (S)-2-Amino-N-((1S,2S,4R)-7,7-dimethyl-1-(((4-(o-tolyl)piperazin-1-yl)sulfonyl)methyl)bicyclo[2.2.1]heptan-2-yl)-4-(methylsulfonyl)butanamide hydrochloride
- CAS
- 160312-62-9
- CID
- 56972193
- IUPAC 名称
- (2S)-2-amino-N-[(1S,2S,4R)-7,7-dimethyl-1-[[4-(2-methylphenyl)piperazin-1-yl]sulfonylmethyl]-2-bicyclo[2.2.1]heptanyl]-4-methylsulfonylbutanamide;hydrochloride
名称与编号
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- (S)-2-Amino-N-((1S,2S,4R)-7,7-dimethyl-1-(((4-(o-tolyl)piperazin-1-yl)sulfonyl)methyl)bicyclo[2.2.1]heptan-2-yl)-4-(methylsulfonyl)butanamide hydrochloride
- CAS
- 160312-62-9
- CID
- 56972193
- IUPAC 名称
- (2S)-2-amino-N-[(1S,2S,4R)-7,7-dimethyl-1-[[4-(2-methylphenyl)piperazin-1-yl]sulfonylmethyl]-2-bicyclo[2.2.1]heptanyl]-4-methylsulfonylbutanamide;hydrochloride
分子属性
- 分子式
- C26H43ClN4O5S2
- 分子量
- 591.2 g/mol
- 精确质量
- 590.2363405 Da
- 单同位素质量
- 590.2363405 Da
- XLogP
- 暂无
- 极性表面积
- 147 Ų
- 氢键供体
- 3
- 氢键受体
- 8
- 可旋转键
- 9
- 重原子数
- 38
- 净电荷
- 0
- 结构复杂度
- 1040
结构标识
- InChIKey
- GIUFQWFJHXXXEQ-SWJTYIIKSA-N
- SMILES
- CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C[C@@]34CC[C@@H](C3(C)C)C[C@@H]4NC(=O)[C@H](CCS(=O)(=O)C)N.Cl
- InChI
- InChI=1S/C26H42N4O5S2.ClH/c1-19-7-5-6-8-22(19)29-12-14-30(15-13-29)37(34,35)18-26-11-9-20(25(26,2)3)17-23(26)28-24(31)21(27)10-16-36(4,32)33;/h5-8,20-21,23H,9-18,27H2,1-4H3,(H,28,31);1H/t20-,21+,23+,26-;/m1./s1