ethyl 4-(2-{[1-(3-chloro-4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}propanamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[1-(3-chloro-4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}propanamido)benzoate
ethyl 4-(2-{[1-(3-chloro-4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}propanamido)benzoate
Compound characteristics
| Compound ID: | L414-1386 |
| Compound Name: | ethyl 4-(2-{[1-(3-chloro-4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}propanamido)benzoate |
| Molecular Weight: | 471.96 |
| Molecular Formula: | C23 H22 Cl N3 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(C(C)SC1C=CC(N(c2ccc(C)c(c2)[Cl])N=1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3676 |
| logD: | 5.3675 |
| logSw: | -6.0285 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.664 |
| InChI Key: | UPEIYYWOSIOADF-HNNXBMFYSA-N |