2-(methylsulfanyl)-7-[(oxolan-2-yl)methyl]pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Chemical Structure Depiction of
2-(methylsulfanyl)-7-[(oxolan-2-yl)methyl]pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
2-(methylsulfanyl)-7-[(oxolan-2-yl)methyl]pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Compound characteristics
| Compound ID: | D718-0842 |
| Compound Name: | 2-(methylsulfanyl)-7-[(oxolan-2-yl)methyl]pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one |
| Molecular Weight: | 317.37 |
| Molecular Formula: | C14 H15 N5 O2 S |
| Smiles: | CSc1nc2N=CC3=C(C=CN(CC4CCCO4)C3=O)n2n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8215 |
| logD: | 0.8215 |
| logSw: | -1.4595 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.185 |
| InChI Key: | KIGUKODWQQQKSB-SECBINFHSA-N |