2-(4-fluorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide
Chemical Structure Depiction of
2-(4-fluorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide
2-(4-fluorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide
Compound characteristics
| Compound ID: | L977-0413 |
| Compound Name: | 2-(4-fluorophenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide |
| Molecular Weight: | 458.51 |
| Molecular Formula: | C25 H19 F N4 O2 S |
| Smiles: | CSc1ccc(CNC(c2ccc3c(c2)C2C(=CN3)C(N(c3ccc(cc3)F)N=2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7439 |
| logD: | 3.7314 |
| logSw: | -4.0915 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.293 |
| InChI Key: | IVTKLKWJUNSTBZ-UHFFFAOYSA-N |