N-(3-chloro-4-methylphenyl)-N'-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)urea
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-N'-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)urea
N-(3-chloro-4-methylphenyl)-N'-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)urea
Compound characteristics
| Compound ID: | G719-1189 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-N'-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)urea |
| Molecular Weight: | 383.88 |
| Molecular Formula: | C20 H22 Cl N5 O |
| Smiles: | Cc1ccc(Cc2nc(CCNC(Nc3ccc(C)c(c3)[Cl])=O)n[nH]2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9648 |
| logD: | 4.9633 |
| logSw: | -4.9615 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.471 |
| InChI Key: | FDKHYCXLQGSLOJ-UHFFFAOYSA-N |