4-[5-(3-chlorophenyl)-1H-1,2,4-triazol-3-yl]aniline
Chemical Structure Depiction of
4-[5-(3-chlorophenyl)-1H-1,2,4-triazol-3-yl]aniline
4-[5-(3-chlorophenyl)-1H-1,2,4-triazol-3-yl]aniline
Compound characteristics
| Compound ID: | 8020-5002 |
| Compound Name: | 4-[5-(3-chlorophenyl)-1H-1,2,4-triazol-3-yl]aniline |
| Molecular Weight: | 270.72 |
| Molecular Formula: | C14 H11 Cl N4 |
| Smiles: | c1cc(cc(c1)[Cl])c1nc(c2ccc(cc2)N)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.4658 |
| logD: | 3.392 |
| logSw: | -3.8498 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 54.558 |
| InChI Key: | XEBZXEAUPFCBBX-UHFFFAOYSA-N |