(2RS)-N-(3,4-dimethoxyphenyl)-4-(methylsulfanyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Chemical Structure Depiction of
(2RS)-N-(3,4-dimethoxyphenyl)-4-(methylsulfanyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
(2RS)-N-(3,4-dimethoxyphenyl)-4-(methylsulfanyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Compound characteristics
| Compound ID: | C561-0213 |
| Compound Name: | (2RS)-N-(3,4-dimethoxyphenyl)-4-(methylsulfanyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C21 H24 N2 O4 S |
| Smiles: | COc1ccc(cc1OC)NC([C@H](CCSC)N1Cc2ccccc2C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7461 |
| logD: | 2.746 |
| logSw: | -3.5127 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.599 |
| InChI Key: | UKAQZEKQYHHHCE-KRWDZBQOSA-N |