4-butyl-1-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
4-butyl-1-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
4-butyl-1-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F798-0405 |
| Compound Name: | 4-butyl-1-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 419.57 |
| Molecular Formula: | C19 H25 N5 O2 S2 |
| Smiles: | CCCCN1C(c2c(ccs2)n2c1nnc2SCC(N1CCCC(C)C1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3987 |
| logD: | 3.3987 |
| logSw: | -3.6341 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.906 |
| InChI Key: | YWPRRWXWJBFOMQ-ZDUSSCGKSA-N |