7-(3,5-dimethoxyphenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Chemical Structure Depiction of
7-(3,5-dimethoxyphenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
7-(3,5-dimethoxyphenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Compound characteristics
| Compound ID: | D718-1030 |
| Compound Name: | 7-(3,5-dimethoxyphenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one |
| Molecular Weight: | 369.4 |
| Molecular Formula: | C17 H15 N5 O3 S |
| Smiles: | COc1cc(cc(c1)OC)N1C=CC2=C(C=Nc3nc(nn23)SC)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.5303 |
| logD: | 2.5303 |
| logSw: | -2.586 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.173 |
| InChI Key: | DHIISAFLTKUEGN-UHFFFAOYSA-N |