(2RS)-N-(3-chloro-4-methoxyphenyl)-4-(methylsulfanyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Chemical Structure Depiction of
(2RS)-N-(3-chloro-4-methoxyphenyl)-4-(methylsulfanyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
(2RS)-N-(3-chloro-4-methoxyphenyl)-4-(methylsulfanyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Compound characteristics
| Compound ID: | C561-0214 |
| Compound Name: | (2RS)-N-(3-chloro-4-methoxyphenyl)-4-(methylsulfanyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide |
| Molecular Weight: | 404.91 |
| Molecular Formula: | C20 H21 Cl N2 O3 S |
| Smiles: | COc1ccc(cc1[Cl])NC([C@H](CCSC)N1Cc2ccccc2C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7218 |
| logD: | 3.721 |
| logSw: | -4.1191 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.969 |
| InChI Key: | IMTHRNUJRBAPTH-KRWDZBQOSA-N |