2,2-dichloro-N-{4-[3-ethoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}acetamide
Chemical Structure Depiction of
2,2-dichloro-N-{4-[3-ethoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}acetamide
2,2-dichloro-N-{4-[3-ethoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}acetamide
Compound characteristics
| Compound ID: | V011-9012 |
| Compound Name: | 2,2-dichloro-N-{4-[3-ethoxy-5-(4-methylphenyl)-1H-1,2,4-triazol-1-yl]phenyl}acetamide |
| Molecular Weight: | 405.28 |
| Molecular Formula: | C19 H18 Cl2 N4 O2 |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2ccc(C)cc2)n(c2ccc(cc2)NC(C([Cl])[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0051 |
| logD: | 5.0022 |
| logSw: | -4.5403 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.176 |
| InChI Key: | ZZAGUYVQXNGCIM-UHFFFAOYSA-N |