N-{2-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-{2-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-3-phenylprop-2-enamide
N-{2-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | G717-1235 |
| Compound Name: | N-{2-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-3-phenylprop-2-enamide |
| Molecular Weight: | 332.4 |
| Molecular Formula: | C20 H20 N4 O |
| Smiles: | Cc1ccc(cc1)c1nc(CCNC(/C=C/c2ccccc2)=O)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.9883 |
| logD: | 3.9763 |
| logSw: | -4.1952 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.055 |
| InChI Key: | VLVPJSBSGTVQDL-UHFFFAOYSA-N |