2-[1-(4-benzylpiperazin-1-yl)-4-(methanesulfonyl)-1-oxobutan-2-yl]-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-[1-(4-benzylpiperazin-1-yl)-4-(methanesulfonyl)-1-oxobutan-2-yl]-2,3-dihydro-1H-isoindol-1-one
2-[1-(4-benzylpiperazin-1-yl)-4-(methanesulfonyl)-1-oxobutan-2-yl]-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | E612-1134 |
| Compound Name: | 2-[1-(4-benzylpiperazin-1-yl)-4-(methanesulfonyl)-1-oxobutan-2-yl]-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C24 H29 N3 O4 S |
| Smiles: | CS(CCC(C(N1CCN(CC1)Cc1ccccc1)=O)N1Cc2ccccc2C1=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1319 |
| logD: | 1.1074 |
| logSw: | -2.3933 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.449 |
| InChI Key: | AMLKDJSIZGSKKX-QFIPXVFZSA-N |