2-(3,4-dimethylphenyl)-N-[3-(methylsulfanyl)phenyl]-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-N-[3-(methylsulfanyl)phenyl]-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide
2-(3,4-dimethylphenyl)-N-[3-(methylsulfanyl)phenyl]-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide
Compound characteristics
Compound ID: | L977-1167 |
Compound Name: | 2-(3,4-dimethylphenyl)-N-[3-(methylsulfanyl)phenyl]-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carboxamide |
Molecular Weight: | 454.55 |
Molecular Formula: | C26 H22 N4 O2 S |
Smiles: | Cc1ccc(cc1C)N1C(C2=CNc3ccc(cc3C2=N1)C(Nc1cccc(c1)SC)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.9279 |
logD: | 4.8285 |
logSw: | -4.5687 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 59.971 |
InChI Key: | LCUNKMOPYDRIJX-UHFFFAOYSA-N |