4-methyl-1-{[(2-methylphenyl)methyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
4-methyl-1-{[(2-methylphenyl)methyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
4-methyl-1-{[(2-methylphenyl)methyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F401-0126 |
| Compound Name: | 4-methyl-1-{[(2-methylphenyl)methyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C16 H14 N4 O S2 |
| Smiles: | Cc1ccccc1CSc1nnc2N(C)C(c3c(ccs3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6699 |
| logD: | 3.6699 |
| logSw: | -3.8022 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.368 |
| InChI Key: | GHTTZNBDXVCXBK-UHFFFAOYSA-N |