2-chloro-N-{4-[3-methoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzamide
Chemical Structure Depiction of
2-chloro-N-{4-[3-methoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzamide
2-chloro-N-{4-[3-methoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzamide
Compound characteristics
| Compound ID: | V004-5500 |
| Compound Name: | 2-chloro-N-{4-[3-methoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzamide |
| Molecular Weight: | 418.88 |
| Molecular Formula: | C23 H19 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)c1nc(nn1c1ccc(cc1)NC(c1ccccc1[Cl])=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.5906 |
| logD: | 5.5898 |
| logSw: | -5.8075 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.325 |
| InChI Key: | YNBINBYTYUVLEI-UHFFFAOYSA-N |