4-(methanesulfonyl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Chemical Structure Depiction of
4-(methanesulfonyl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
4-(methanesulfonyl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Compound characteristics
| Compound ID: | E612-1229 |
| Compound Name: | 4-(methanesulfonyl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide |
| Molecular Weight: | 446.59 |
| Molecular Formula: | C22 H26 N2 O4 S2 |
| Smiles: | CSc1ccc(CCNC(C(CCS(C)(=O)=O)N2Cc3ccccc3C2=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.971 |
| logD: | 1.971 |
| logSw: | -2.8448 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.515 |
| InChI Key: | POASSFFOBDJSPU-FQEVSTJZSA-N |