ethyl 5-[3-(4-cyanobenzamido)phenyl]-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[3-(4-cyanobenzamido)phenyl]-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate
ethyl 5-[3-(4-cyanobenzamido)phenyl]-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V010-9458 |
| Compound Name: | ethyl 5-[3-(4-cyanobenzamido)phenyl]-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 450.5 |
| Molecular Formula: | C27 H22 N4 O3 |
| Smiles: | CCOC(c1cc(c2cccc(c2)NC(c2ccc(C#N)cc2)=O)n(c2cccc(C)c2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5022 |
| logD: | 5.5022 |
| logSw: | -5.3904 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.963 |
| InChI Key: | DIHGRDJNHFVMPM-UHFFFAOYSA-N |