N-{4-[5-(3,4-dichlorophenyl)-3-methoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{4-[5-(3,4-dichlorophenyl)-3-methoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
N-{4-[5-(3,4-dichlorophenyl)-3-methoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | V024-9398 |
| Compound Name: | N-{4-[5-(3,4-dichlorophenyl)-3-methoxy-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide |
| Molecular Weight: | 453.33 |
| Molecular Formula: | C23 H18 Cl2 N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(Nc1ccc(cc1)n1c(c2ccc(c(c2)[Cl])[Cl])nc(n1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4177 |
| logD: | 6.4176 |
| logSw: | -6.4442 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.325 |
| InChI Key: | INASTTXNGJCBJA-UHFFFAOYSA-N |