ethyl 2-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate
ethyl 2-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | D223-0973 |
| Compound Name: | ethyl 2-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate |
| Molecular Weight: | 477.51 |
| Molecular Formula: | C25 H20 F N3 O4 S |
| Smiles: | [H]N(C(C1C(C=CN(c2ccc(cc2)F)N=1)=O)=O)c1c(C(=O)OCC)c(cs1)c1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9587 |
| logD: | 3.0586 |
| logSw: | -4.7302 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.017 |
| InChI Key: | FEMKDUFVHSMAAA-UHFFFAOYSA-N |