ethyl 1-(4-{[2-(2,4-dichlorophenyl)ethyl]carbamoyl}phenyl)-5-(pentan-3-yl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-{[2-(2,4-dichlorophenyl)ethyl]carbamoyl}phenyl)-5-(pentan-3-yl)-1H-pyrazole-3-carboxylate
ethyl 1-(4-{[2-(2,4-dichlorophenyl)ethyl]carbamoyl}phenyl)-5-(pentan-3-yl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V012-0823 |
| Compound Name: | ethyl 1-(4-{[2-(2,4-dichlorophenyl)ethyl]carbamoyl}phenyl)-5-(pentan-3-yl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 502.44 |
| Molecular Formula: | C26 H29 Cl2 N3 O3 |
| Smiles: | CCC(CC)c1cc(C(=O)OCC)nn1c1ccc(cc1)C(NCCc1ccc(cc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4842 |
| logD: | 6.4842 |
| logSw: | -6.3453 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.341 |
| InChI Key: | ATPZWVGJEYKWEM-UHFFFAOYSA-N |