N~3~-(3-chlorophenyl)-1H-1,2,4-triazole-3,5-diamine
Chemical Structure Depiction of
N~3~-(3-chlorophenyl)-1H-1,2,4-triazole-3,5-diamine
N~3~-(3-chlorophenyl)-1H-1,2,4-triazole-3,5-diamine
Compound characteristics
| Compound ID: | Y021-0245 |
| Compound Name: | N~3~-(3-chlorophenyl)-1H-1,2,4-triazole-3,5-diamine |
| Molecular Weight: | 209.63 |
| Molecular Formula: | C8 H8 Cl N5 |
| Smiles: | c1cc(cc(c1)[Cl])Nc1nc(N)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 2.2226 |
| logD: | 2.1473 |
| logSw: | -2.9881 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 64.808 |
| InChI Key: | RPFUCBPCSIJVSM-UHFFFAOYSA-N |