7-(5-chloro-2-methylphenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Chemical Structure Depiction of
7-(5-chloro-2-methylphenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
7-(5-chloro-2-methylphenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Compound characteristics
| Compound ID: | Y020-3141 |
| Compound Name: | 7-(5-chloro-2-methylphenyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one |
| Molecular Weight: | 357.82 |
| Molecular Formula: | C16 H12 Cl N5 O S |
| Smiles: | Cc1ccc(cc1N1C=CC2=C(C=Nc3nc(nn23)SC)C1=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2612 |
| logD: | 3.2612 |
| logSw: | -3.4522 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.784 |
| InChI Key: | AJQVBNBVAGPQEC-UHFFFAOYSA-N |