1-{[(3-methoxyphenyl)methyl]sulfanyl}-4-methylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
1-{[(3-methoxyphenyl)methyl]sulfanyl}-4-methylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-{[(3-methoxyphenyl)methyl]sulfanyl}-4-methylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F401-0148 |
| Compound Name: | 1-{[(3-methoxyphenyl)methyl]sulfanyl}-4-methylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C16 H14 N4 O2 S2 |
| Smiles: | CN1C(c2c(ccs2)n2c1nnc2SCc1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9251 |
| logD: | 2.9251 |
| logSw: | -3.35 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.911 |
| InChI Key: | LXAWVINJAKDTBN-UHFFFAOYSA-N |