4-[(2-ethoxyphenyl)methyl]-1-(methylsulfanyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
4-[(2-ethoxyphenyl)methyl]-1-(methylsulfanyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
4-[(2-ethoxyphenyl)methyl]-1-(methylsulfanyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F401-0522 |
| Compound Name: | 4-[(2-ethoxyphenyl)methyl]-1-(methylsulfanyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 372.47 |
| Molecular Formula: | C17 H16 N4 O2 S2 |
| Smiles: | CCOc1ccccc1CN1C(c2c(ccs2)n2c1nnc2SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5657 |
| logD: | 3.5657 |
| logSw: | -3.6467 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.812 |
| InChI Key: | BTOTXGUJNNEJLK-UHFFFAOYSA-N |