7-(2,3-dichlorophenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Chemical Structure Depiction of
7-(2,3-dichlorophenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
7-(2,3-dichlorophenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Compound characteristics
| Compound ID: | Y021-0669 |
| Compound Name: | 7-(2,3-dichlorophenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one |
| Molecular Weight: | 378.24 |
| Molecular Formula: | C15 H9 Cl2 N5 O S |
| Smiles: | CSc1nc2N=CC3=C(C=CN(C3=O)c3cccc(c3[Cl])[Cl])n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3968 |
| logD: | 3.3968 |
| logSw: | -3.9569 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.784 |
| InChI Key: | IVRIGHFRKSAQBI-UHFFFAOYSA-N |