N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | V002-7439 |
| Compound Name: | N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide |
| Molecular Weight: | 416.45 |
| Molecular Formula: | C24 H21 F N4 O2 |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2cccc(c2)F)n(c2ccc(cc2)NC(c2ccc(C)cc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7004 |
| logD: | 5.7003 |
| logSw: | -5.388 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.905 |
| InChI Key: | ATYDZZOREXEPJN-UHFFFAOYSA-N |