[5-amino-3-(4-methylphenyl)-1H-1,2,4-triazol-1-yl](3-chlorophenyl)methanone
Chemical Structure Depiction of
[5-amino-3-(4-methylphenyl)-1H-1,2,4-triazol-1-yl](3-chlorophenyl)methanone
[5-amino-3-(4-methylphenyl)-1H-1,2,4-triazol-1-yl](3-chlorophenyl)methanone
Compound characteristics
| Compound ID: | D481-1813 |
| Compound Name: | [5-amino-3-(4-methylphenyl)-1H-1,2,4-triazol-1-yl](3-chlorophenyl)methanone |
| Molecular Weight: | 312.76 |
| Molecular Formula: | C16 H13 Cl N4 O |
| Smiles: | Cc1ccc(cc1)c1nc(N)n(C(c2cccc(c2)[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6096 |
| logD: | 3.6096 |
| logSw: | -3.8776 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.847 |
| InChI Key: | GQTHKJCFDQMUPV-UHFFFAOYSA-N |