2-(1-benzyl-1H-pyrrol-2-yl)-N-[3-(methylsulfanyl)phenyl]-2-oxoacetamide
Chemical Structure Depiction of
2-(1-benzyl-1H-pyrrol-2-yl)-N-[3-(methylsulfanyl)phenyl]-2-oxoacetamide
2-(1-benzyl-1H-pyrrol-2-yl)-N-[3-(methylsulfanyl)phenyl]-2-oxoacetamide
Compound characteristics
| Compound ID: | L793-3265 |
| Compound Name: | 2-(1-benzyl-1H-pyrrol-2-yl)-N-[3-(methylsulfanyl)phenyl]-2-oxoacetamide |
| Molecular Weight: | 350.44 |
| Molecular Formula: | C20 H18 N2 O2 S |
| Smiles: | CSc1cccc(c1)NC(C(c1cccn1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3866 |
| logD: | 4.3863 |
| logSw: | -4.3168 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.658 |
| InChI Key: | BKTGSAUSHQZRIV-UHFFFAOYSA-N |