butyl 4-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
butyl 4-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate
butyl 4-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D223-0340 |
| Compound Name: | butyl 4-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate |
| Molecular Weight: | 409.42 |
| Molecular Formula: | C22 H20 F N3 O4 |
| Smiles: | [H]N(C(C1C(C=CN(c2ccc(cc2)F)N=1)=O)=O)c1ccc(cc1)C(=O)OCCCC |
| Stereo: | ACHIRAL |
| logP: | 4.4756 |
| logD: | 4.2792 |
| logSw: | -4.2426 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.788 |
| InChI Key: | CFJNQXFGSWMNGO-UHFFFAOYSA-N |