N-{4-[5-(3,4-dichlorophenyl)-3-ethoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{4-[5-(3,4-dichlorophenyl)-3-ethoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
N-{4-[5-(3,4-dichlorophenyl)-3-ethoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | V025-1110 |
| Compound Name: | N-{4-[5-(3,4-dichlorophenyl)-3-ethoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide |
| Molecular Weight: | 467.35 |
| Molecular Formula: | C24 H20 Cl2 N4 O2 |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2ccc(c(c2)[Cl])[Cl])n(c2ccc(cc2)NC(c2ccc(C)cc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.8617 |
| logD: | 6.8616 |
| logSw: | -6.469 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.905 |
| InChI Key: | ZZVMGVLJUFHYSL-UHFFFAOYSA-N |