4-[(2-methoxyphenyl)methyl]-1-{[(3-methoxyphenyl)methyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
4-[(2-methoxyphenyl)methyl]-1-{[(3-methoxyphenyl)methyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
4-[(2-methoxyphenyl)methyl]-1-{[(3-methoxyphenyl)methyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F401-0366 |
| Compound Name: | 4-[(2-methoxyphenyl)methyl]-1-{[(3-methoxyphenyl)methyl]sulfanyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 464.56 |
| Molecular Formula: | C23 H20 N4 O3 S2 |
| Smiles: | COc1cccc(CSc2nnc3N(Cc4ccccc4OC)C(c4c(ccs4)n23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.717 |
| logD: | 4.717 |
| logSw: | -4.5107 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.505 |
| InChI Key: | OHJMNTNCIYADEY-UHFFFAOYSA-N |