methyl 3-{[2-(4-fluorophenyl)-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[2-(4-fluorophenyl)-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carbonyl]amino}benzoate
methyl 3-{[2-(4-fluorophenyl)-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | L977-0099 |
| Compound Name: | methyl 3-{[2-(4-fluorophenyl)-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]quinoline-8-carbonyl]amino}benzoate |
| Molecular Weight: | 456.43 |
| Molecular Formula: | C25 H17 F N4 O4 |
| Smiles: | COC(c1cccc(c1)NC(c1ccc2c(c1)C1C(=CN2)C(N(c2ccc(cc2)F)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.63 |
| logD: | 3.6176 |
| logSw: | -4.0865 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.145 |
| InChI Key: | JGHNHVCJBCOBDR-UHFFFAOYSA-N |