2-[6-(4-chlorophenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-[6-(4-chlorophenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
2-[6-(4-chlorophenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | P244-1010 |
| Compound Name: | 2-[6-(4-chlorophenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide |
| Molecular Weight: | 437.95 |
| Molecular Formula: | C23 H20 Cl N3 O2 S |
| Smiles: | CSc1ccc(CNC(CC2c3c(cccn3)C(N2c2ccc(cc2)[Cl])=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1191 |
| logD: | 4.1191 |
| logSw: | -4.5832 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.738 |
| InChI Key: | IBIBJBIEDWRVBY-FQEVSTJZSA-N |