N-[(4-methylphenyl)methyl]-N'-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)urea
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-N'-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)urea
N-[(4-methylphenyl)methyl]-N'-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)urea
Compound characteristics
| Compound ID: | G719-1237 |
| Compound Name: | N-[(4-methylphenyl)methyl]-N'-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)urea |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C21 H25 N5 O |
| Smiles: | Cc1ccc(Cc2nc(CCNC(NCc3ccc(C)cc3)=O)n[nH]2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2466 |
| logD: | 3.2451 |
| logSw: | -3.2999 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.793 |
| InChI Key: | FRQYYWOJGJGBAC-UHFFFAOYSA-N |