(2S)-4-(methanesulfonyl)-N-[(4-methylphenyl)methyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Chemical Structure Depiction of
(2S)-4-(methanesulfonyl)-N-[(4-methylphenyl)methyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
(2S)-4-(methanesulfonyl)-N-[(4-methylphenyl)methyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Compound characteristics
| Compound ID: | C561-0422 |
| Compound Name: | (2S)-4-(methanesulfonyl)-N-[(4-methylphenyl)methyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C21 H24 N2 O4 S |
| Smiles: | Cc1ccc(CNC([C@H](CCS(C)(=O)=O)N2Cc3ccccc3C2=O)=O)cc1 |
| Stereo: | ABSOLUTE |
| logP: | 1.5015 |
| logD: | 1.5015 |
| logSw: | -2.5349 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.674 |
| InChI Key: | MCUVBVPDFGAQOB-IBGZPJMESA-N |