N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-N'-[3-(trifluoromethyl)phenyl]urea
Chemical Structure Depiction of
N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-N'-[3-(trifluoromethyl)phenyl]urea
N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-N'-[3-(trifluoromethyl)phenyl]urea
Compound characteristics
| Compound ID: | G719-1235 |
| Compound Name: | N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-N'-[3-(trifluoromethyl)phenyl]urea |
| Molecular Weight: | 403.41 |
| Molecular Formula: | C20 H20 F3 N5 O |
| Smiles: | Cc1ccc(Cc2nc(CCNC(Nc3cccc(c3)C(F)(F)F)=O)n[nH]2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6178 |
| logD: | 4.6164 |
| logSw: | -4.3825 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.471 |
| InChI Key: | KZBDCHHECJEHMR-UHFFFAOYSA-N |