methyl 3-({1-[1-(3-chloro-4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperidine-4-carbonyl}amino)thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-({1-[1-(3-chloro-4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperidine-4-carbonyl}amino)thiophene-2-carboxylate
methyl 3-({1-[1-(3-chloro-4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperidine-4-carbonyl}amino)thiophene-2-carboxylate
Compound characteristics
| Compound ID: | F699-0897 |
| Compound Name: | methyl 3-({1-[1-(3-chloro-4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperidine-4-carbonyl}amino)thiophene-2-carboxylate |
| Molecular Weight: | 486.98 |
| Molecular Formula: | C23 H23 Cl N4 O4 S |
| Smiles: | Cc1ccc(cc1[Cl])N1C(C=CC(=N1)N1CCC(CC1)C(Nc1ccsc1C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7762 |
| logD: | 3.64 |
| logSw: | -4.1705 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.29 |
| InChI Key: | HRFFEBGHQADSJQ-UHFFFAOYSA-N |