1-[5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one
1-[5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | D481-2220 |
| Compound Name: | 1-[5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl]-2-(4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C19 H20 N4 O2 |
| Smiles: | Cc1ccc(cc1C)c1nc(N)n(C(Cc2ccc(cc2)OC)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6142 |
| logD: | 3.6116 |
| logSw: | -3.8262 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.863 |
| InChI Key: | POZYYFQGKWSOFA-UHFFFAOYSA-N |