N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-2-phenyl-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-2-phenyl-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide
N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-2-phenyl-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide
Compound characteristics
| Compound ID: | L977-0524 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-2-phenyl-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C25 H20 N4 O2 S |
| Smiles: | CSc1ccc(CNC(c2ccc3c(c2)C2C(=CN3)C(N(c3ccccc3)N=2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5933 |
| logD: | 3.5693 |
| logSw: | -3.9201 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.293 |
| InChI Key: | COAMNKNKAXBVSG-UHFFFAOYSA-N |