[5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl](4-chlorophenyl)methanone
Chemical Structure Depiction of
[5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl](4-chlorophenyl)methanone
[5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl](4-chlorophenyl)methanone
Compound characteristics
| Compound ID: | D481-2226 |
| Compound Name: | [5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl](4-chlorophenyl)methanone |
| Molecular Weight: | 326.78 |
| Molecular Formula: | C17 H15 Cl N4 O |
| Smiles: | Cc1ccc(cc1C)c1nc(N)n(C(c2ccc(cc2)[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.1864 |
| logD: | 4.1864 |
| logSw: | -4.5504 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.847 |
| InChI Key: | HMPYLUCUQZQCIZ-UHFFFAOYSA-N |