1-[4-(dimethylamino)phenyl]-5-methyl-2-(1H-1,2,4-triazol-1-yl)hex-1-en-3-one
Chemical Structure Depiction of
1-[4-(dimethylamino)phenyl]-5-methyl-2-(1H-1,2,4-triazol-1-yl)hex-1-en-3-one
1-[4-(dimethylamino)phenyl]-5-methyl-2-(1H-1,2,4-triazol-1-yl)hex-1-en-3-one
Compound characteristics
| Compound ID: | D155-0018 |
| Compound Name: | 1-[4-(dimethylamino)phenyl]-5-methyl-2-(1H-1,2,4-triazol-1-yl)hex-1-en-3-one |
| Molecular Weight: | 298.39 |
| Molecular Formula: | C17 H22 N4 O |
| Smiles: | CC(C)CC(/C(=C/c1ccc(cc1)N(C)C)n1cncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.031 |
| logD: | 3.0304 |
| logSw: | -3.3885 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.996 |
| InChI Key: | SEUXSKIAVQJLHR-UHFFFAOYSA-N |