(2RS)-3-(benzylsulfanyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Chemical Structure Depiction of
(2RS)-3-(benzylsulfanyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
(2RS)-3-(benzylsulfanyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Compound characteristics
| Compound ID: | C561-0407 |
| Compound Name: | (2RS)-3-(benzylsulfanyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide |
| Molecular Weight: | 518.68 |
| Molecular Formula: | C30 H34 N2 O4 S |
| Smiles: | CCOc1ccc(CCNC([C@H](CSCc2ccccc2)N2Cc3ccccc3C2=O)=O)cc1OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1969 |
| logD: | 4.1969 |
| logSw: | -4.2154 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.651 |
| InChI Key: | SVTNANLIJQMHEH-SANMLTNESA-N |