Primary record
4-[4-[[2-[3-(difluoromethyl)-1-bicyclo[1.1.1]pentanyl]-4,4-dimethyl-cyclohexen-1-yl]methyl]piperazin-1-yl]-N-[4-[[(1R)-1-(phenylsulfanylmethyl)-3-piperazin-1-yl-propyl]amino]-3-(trifluoromethylsulfonyl)phenyl]sulfonyl-benzamide
- 库存
- 550 克
- 纯度
- 98.1 %
化合物标识与属性
- PubChem CID
- 145999592
- SMILES
- CC1(CCC(=C(C1)C23CC(C2)(C3)C(F)F)CN4CCN(CC4)C5=CC=C(C=C5)C(=O)NS(=O)(=O)C6=CC(=C(C=C6)N[C@H](CCN7CCNCC7)CSC8=CC=CC=C8)S(=O)(=O)C(F)(F)F)C
- Canonical SMILES
- CC1(C)CCC(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@H](CCN5CCNCC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)=C(C23CC(C(F)F)(C2)C3)C1
名称与同义词
- CHEMBL6041335
- SCHEMBL22581306
- SCHEMBL29658234
- BDBM552944
- BDBM555340
- US11318134, Example 64
- US11344546, Example 64
- (R)-4-(4-((2-(3-(difluoromethyl)bicyclo[1.1.1]pentan-1-yl)-4,4-dimethylcyclohex-1-en-1-yl)methyl)piperazin-1-yl)-N-((4-((1-(phenylthio)-4-(piperazin-1-yl)butan-2-yl)amino)-3-((trifluoromethyl)sulfonyl)phenyl)sulfonyl)benzamide
- 4-[4-[[2-[3-(difluoromethyl)-1-bicyclo[1.1.1]pentanyl]-4,4-dimethyl-cyclohexen-1-yl]methyl]piperazin-1-yl]-N-[4-[[(1R)-1-(phenylsulfanylmethyl)-3-piperazin-1-yl-propyl]amino]-3-(trifluoromethylsulfonyl)phenyl]sulfonyl-benzamide