1-[(2-chlorophenyl)methyl]-1H-1,2,4-triazol-3-amine
Chemical Structure Depiction of
1-[(2-chlorophenyl)methyl]-1H-1,2,4-triazol-3-amine
1-[(2-chlorophenyl)methyl]-1H-1,2,4-triazol-3-amine
Compound characteristics
| Compound ID: | Y503-2548 |
| Compound Name: | 1-[(2-chlorophenyl)methyl]-1H-1,2,4-triazol-3-amine |
| Molecular Weight: | 208.65 |
| Molecular Formula: | C9 H9 Cl N4 |
| Smiles: | C(c1ccccc1[Cl])n1cnc(N)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.6986 |
| logD: | 1.6973 |
| logSw: | -1.9488 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.792 |
| InChI Key: | AYHQHOGLGCSGJN-UHFFFAOYSA-N |