ethyl 5-[3-(3-cyanobenzamido)phenyl]-1-(3-fluorophenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[3-(3-cyanobenzamido)phenyl]-1-(3-fluorophenyl)-1H-pyrazole-3-carboxylate
ethyl 5-[3-(3-cyanobenzamido)phenyl]-1-(3-fluorophenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V011-5808 |
| Compound Name: | ethyl 5-[3-(3-cyanobenzamido)phenyl]-1-(3-fluorophenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 454.46 |
| Molecular Formula: | C26 H19 F N4 O3 |
| Smiles: | CCOC(c1cc(c2cccc(c2)NC(c2cccc(C#N)c2)=O)n(c2cccc(c2)F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.046 |
| logD: | 5.0459 |
| logSw: | -4.6864 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.963 |
| InChI Key: | PVSQCJJLCPYYSJ-UHFFFAOYSA-N |