N-(3-acetylphenyl)-3-(1H-1,2,4-triazol-1-yl)propanamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-3-(1H-1,2,4-triazol-1-yl)propanamide
N-(3-acetylphenyl)-3-(1H-1,2,4-triazol-1-yl)propanamide
Compound characteristics
| Compound ID: | 8018-1300 |
| Compound Name: | N-(3-acetylphenyl)-3-(1H-1,2,4-triazol-1-yl)propanamide |
| Molecular Weight: | 258.28 |
| Molecular Formula: | C13 H14 N4 O2 |
| Smiles: | CC(c1cccc(c1)NC(CCn1cncn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4218 |
| logD: | 0.4216 |
| logSw: | -1.7163 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.17 |
| InChI Key: | DQUPUEWWBMOPQI-UHFFFAOYSA-N |