ethyl 5-[3-(4-cyanobenzamido)phenyl]-1-(2-fluorophenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[3-(4-cyanobenzamido)phenyl]-1-(2-fluorophenyl)-1H-pyrazole-3-carboxylate
ethyl 5-[3-(4-cyanobenzamido)phenyl]-1-(2-fluorophenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V011-1175 |
| Compound Name: | ethyl 5-[3-(4-cyanobenzamido)phenyl]-1-(2-fluorophenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 454.46 |
| Molecular Formula: | C26 H19 F N4 O3 |
| Smiles: | CCOC(c1cc(c2cccc(c2)NC(c2ccc(C#N)cc2)=O)n(c2ccccc2F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9881 |
| logD: | 4.988 |
| logSw: | -4.5862 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.662 |
| InChI Key: | LMSZBLFNIRYDAO-UHFFFAOYSA-N |