3-chloro-N-{4-[5-(3,4-dichlorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-2,2-dimethylpropanamide
Chemical Structure Depiction of
3-chloro-N-{4-[5-(3,4-dichlorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-2,2-dimethylpropanamide
3-chloro-N-{4-[5-(3,4-dichlorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-2,2-dimethylpropanamide
Compound characteristics
| Compound ID: | V002-7469 |
| Compound Name: | 3-chloro-N-{4-[5-(3,4-dichlorophenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-2,2-dimethylpropanamide |
| Molecular Weight: | 495.84 |
| Molecular Formula: | C23 H25 Cl3 N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)COc1nc(c2ccc(c(c2)[Cl])[Cl])n(c2ccc(cc2)NC(C(C)(C)C[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.4707 |
| logD: | 7.4706 |
| logSw: | -6.5481 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.552 |
| InChI Key: | LCSIUBVHFPZSKN-UHFFFAOYSA-N |