butyl 4-{[1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
butyl 4-{[1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate
butyl 4-{[1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D223-0121 |
| Compound Name: | butyl 4-{[1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C23 H23 N3 O4 |
| Smiles: | [H]N(C(C1C(C=CN(c2cccc(C)c2)N=1)=O)=O)c1ccc(cc1)C(=O)OCCCC |
| Stereo: | ACHIRAL |
| logP: | 4.9143 |
| logD: | 4.7179 |
| logSw: | -4.6648 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.788 |
| InChI Key: | VHOPPJIGVAWXIL-UHFFFAOYSA-N |