1-{[(3-methylphenyl)methyl]sulfanyl}-4-(2-phenylethyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
1-{[(3-methylphenyl)methyl]sulfanyl}-4-(2-phenylethyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-{[(3-methylphenyl)methyl]sulfanyl}-4-(2-phenylethyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F401-0257 |
| Compound Name: | 1-{[(3-methylphenyl)methyl]sulfanyl}-4-(2-phenylethyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 432.57 |
| Molecular Formula: | C23 H20 N4 O S2 |
| Smiles: | Cc1cccc(CSc2nnc3N(CCc4ccccc4)C(c4c(ccs4)n23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.4553 |
| logD: | 5.4553 |
| logSw: | -5.3529 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.309 |
| InChI Key: | GEQIAIGEELKPGF-UHFFFAOYSA-N |