N-{4-[3-ethoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluoro-3-methylbenzamide
Chemical Structure Depiction of
N-{4-[3-ethoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluoro-3-methylbenzamide
N-{4-[3-ethoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluoro-3-methylbenzamide
Compound characteristics
| Compound ID: | V003-5387 |
| Compound Name: | N-{4-[3-ethoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-fluoro-3-methylbenzamide |
| Molecular Weight: | 430.48 |
| Molecular Formula: | C25 H23 F N4 O2 |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2ccc(C)cc2)n(c2ccc(cc2)NC(c2ccc(c(C)c2)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.0358 |
| logD: | 6.0331 |
| logSw: | -5.4064 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.905 |
| InChI Key: | QOTFCYRQDWNTNW-UHFFFAOYSA-N |