ethyl 5-tert-butyl-1-(4-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-tert-butyl-1-(4-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
ethyl 5-tert-butyl-1-(4-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V003-5624 |
| Compound Name: | ethyl 5-tert-butyl-1-(4-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 439.94 |
| Molecular Formula: | C24 H26 Cl N3 O3 |
| Smiles: | CCOC(c1cc(C(C)(C)C)n(c2ccc(cc2)C(NCc2ccc(cc2)[Cl])=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0341 |
| logD: | 5.034 |
| logSw: | -5.2035 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.5 |
| InChI Key: | HHTCCHTWNXPPIK-UHFFFAOYSA-N |