1-(5-amino-3-phenyl-1H-1,2,4-triazol-1-yl)-2-(4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-(5-amino-3-phenyl-1H-1,2,4-triazol-1-yl)-2-(4-methoxyphenyl)ethan-1-one
1-(5-amino-3-phenyl-1H-1,2,4-triazol-1-yl)-2-(4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | D481-1750 |
| Compound Name: | 1-(5-amino-3-phenyl-1H-1,2,4-triazol-1-yl)-2-(4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 308.34 |
| Molecular Formula: | C17 H16 N4 O2 |
| Smiles: | COc1ccc(CC(n2c(N)nc(c3ccccc3)n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.525 |
| logD: | 2.5224 |
| logSw: | -2.5233 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.863 |
| InChI Key: | NUXWHXWURVMKDI-UHFFFAOYSA-N |