4-(methanesulfonyl)-N-[(3-methoxyphenyl)methyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Chemical Structure Depiction of
4-(methanesulfonyl)-N-[(3-methoxyphenyl)methyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
4-(methanesulfonyl)-N-[(3-methoxyphenyl)methyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Compound characteristics
| Compound ID: | E612-1145 |
| Compound Name: | 4-(methanesulfonyl)-N-[(3-methoxyphenyl)methyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide |
| Molecular Weight: | 416.49 |
| Molecular Formula: | C21 H24 N2 O5 S |
| Smiles: | COc1cccc(CNC(C(CCS(C)(=O)=O)N2Cc3ccccc3C2=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1754 |
| logD: | 1.1754 |
| logSw: | -2.4868 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.217 |
| InChI Key: | TXCNUPFAROWIRU-IBGZPJMESA-N |