N-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-hexylbenzamide
Chemical Structure Depiction of
N-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-hexylbenzamide
N-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-hexylbenzamide
Compound characteristics
| Compound ID: | V017-5082 |
| Compound Name: | N-{4-[5-(2-fluorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-hexylbenzamide |
| Molecular Weight: | 514.64 |
| Molecular Formula: | C31 H35 F N4 O2 |
| Salt: | not_available |
| Smiles: | CCCCCCc1ccc(cc1)C(Nc1ccc(cc1)n1c(c2ccccc2F)nc(n1)OCC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 8.82 |
| logD: | 8.8199 |
| logSw: | -5.7644 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.28 |
| InChI Key: | HICIIFDFFIAROL-UHFFFAOYSA-N |