N-(3-chloro-2-methylphenyl)-N'-{1-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}urea
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-N'-{1-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}urea
N-(3-chloro-2-methylphenyl)-N'-{1-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}urea
Compound characteristics
| Compound ID: | Y205-4750 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-N'-{1-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}urea |
| Molecular Weight: | 355.83 |
| Molecular Formula: | C18 H18 Cl N5 O |
| Smiles: | Cc1cccc(Cn2cnc(NC(Nc3cccc(c3C)[Cl])=O)n2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.7908 |
| logD: | 4.7748 |
| logSw: | -4.8807 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.065 |
| InChI Key: | IYFPJBLHHBJNDN-UHFFFAOYSA-N |