ethyl ({5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
ethyl ({5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | Y206-1287 |
| Compound Name: | ethyl ({5-[4-(dimethylamino)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate |
| Molecular Weight: | 320.41 |
| Molecular Formula: | C15 H20 N4 O2 S |
| Smiles: | CCOC(CSc1nnc(c2ccc(cc2)N(C)C)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.516 |
| logD: | 2.5159 |
| logSw: | -2.5192 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.286 |
| InChI Key: | AVDMGTYYXICTOJ-UHFFFAOYSA-N |