ethyl 2-{[1-(4-ethylphenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[1-(4-ethylphenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate
ethyl 2-{[1-(4-ethylphenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | D223-1059 |
| Compound Name: | ethyl 2-{[1-(4-ethylphenyl)-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate |
| Molecular Weight: | 487.58 |
| Molecular Formula: | C27 H25 N3 O4 S |
| Smiles: | [H]N(C(C1C(C=CN(c2ccc(CC)cc2)N=1)=O)=O)c1c(C(=O)OCC)c(cs1)c1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8603 |
| logD: | 3.9602 |
| logSw: | -5.5731 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.017 |
| InChI Key: | MJOBSRVRYAGWSN-UHFFFAOYSA-N |