(2RS)-N-[(1RS)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Chemical Structure Depiction of
(2RS)-N-[(1RS)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
(2RS)-N-[(1RS)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Compound characteristics
| Compound ID: | Y043-4452 |
| Compound Name: | (2RS)-N-[(1RS)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C22 H24 N4 O2 S |
| Smiles: | C[C@@H](C(N[C@@H](CCSC)c1nc2ccccc2[nH]1)=O)N1Cc2ccccc2C1=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7045 |
| logD: | 2.7027 |
| logSw: | -3.3284 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.998 |
| InChI Key: | PPKULGSGPUJIKA-LIRRHRJNSA-N |