(2RS)-3-(benzylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Chemical Structure Depiction of
(2RS)-3-(benzylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
(2RS)-3-(benzylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Compound characteristics
| Compound ID: | C561-0409 |
| Compound Name: | (2RS)-3-(benzylsulfanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C26 H24 N2 O4 S |
| Smiles: | C1c2ccccc2C(N1[C@@H](CSCc1ccccc1)C(Nc1ccc2c(c1)OCCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.387 |
| logD: | 3.3866 |
| logSw: | -3.8319 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.89 |
| InChI Key: | PRFYVJVXKADAHK-QFIPXVFZSA-N |