N-{3-[5-(3,4-dichlorophenyl)-3-methoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-fluorobenzamide
Chemical Structure Depiction of
N-{3-[5-(3,4-dichlorophenyl)-3-methoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-fluorobenzamide
N-{3-[5-(3,4-dichlorophenyl)-3-methoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | V004-0138 |
| Compound Name: | N-{3-[5-(3,4-dichlorophenyl)-3-methoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-fluorobenzamide |
| Molecular Weight: | 457.29 |
| Molecular Formula: | C22 H15 Cl2 F N4 O2 |
| Salt: | not_available |
| Smiles: | COc1nc(c2ccc(c(c2)[Cl])[Cl])n(c2cccc(c2)NC(c2ccc(cc2)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.2544 |
| logD: | 6.2543 |
| logSw: | -6.4331 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.325 |
| InChI Key: | WFUHKLGLGBHKTK-UHFFFAOYSA-N |