N-(3-{5-(3,4-dichlorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)-3-methylbutanamide
Chemical Structure Depiction of
N-(3-{5-(3,4-dichlorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)-3-methylbutanamide
N-(3-{5-(3,4-dichlorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)-3-methylbutanamide
Compound characteristics
| Compound ID: | V004-1229 |
| Compound Name: | N-(3-{5-(3,4-dichlorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)-3-methylbutanamide |
| Molecular Weight: | 447.36 |
| Molecular Formula: | C22 H24 Cl2 N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1cccc(c1)n1c(c2ccc(c(c2)[Cl])[Cl])nc(n1)OC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7747 |
| logD: | 6.7747 |
| logSw: | -6.528 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.642 |
| InChI Key: | PLXHGMMCNRKONG-UHFFFAOYSA-N |