N-{1-[(2-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-N'-(3-fluorophenyl)urea
Chemical Structure Depiction of
N-{1-[(2-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-N'-(3-fluorophenyl)urea
N-{1-[(2-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-N'-(3-fluorophenyl)urea
Compound characteristics
| Compound ID: | Y205-5410 |
| Compound Name: | N-{1-[(2-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-N'-(3-fluorophenyl)urea |
| Molecular Weight: | 345.76 |
| Molecular Formula: | C16 H13 Cl F N5 O |
| Smiles: | C(c1ccccc1[Cl])n1cnc(NC(Nc2cccc(c2)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.142 |
| logD: | 4.1373 |
| logSw: | -4.4017 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.763 |
| InChI Key: | VZZNZUVWSAYBMX-UHFFFAOYSA-N |