N-[3-(methylsulfanyl)phenyl]-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
N-[3-(methylsulfanyl)phenyl]-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | J099-1027 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-6-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide |
| Molecular Weight: | 336.41 |
| Molecular Formula: | C19 H16 N2 O2 S |
| Smiles: | CSc1cccc(c1)NC(C1=CN2CCc3cccc(C1=O)c23)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4184 |
| logD: | 3.4177 |
| logSw: | -4.0131 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.34 |
| InChI Key: | MUKQYVKJIGCTOD-UHFFFAOYSA-N |