1-{[(4-fluorophenyl)methyl]sulfanyl}-4-[(2-methoxyphenyl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
1-{[(4-fluorophenyl)methyl]sulfanyl}-4-[(2-methoxyphenyl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-{[(4-fluorophenyl)methyl]sulfanyl}-4-[(2-methoxyphenyl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F401-0354 |
| Compound Name: | 1-{[(4-fluorophenyl)methyl]sulfanyl}-4-[(2-methoxyphenyl)methyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 452.53 |
| Molecular Formula: | C22 H17 F N4 O2 S2 |
| Smiles: | COc1ccccc1CN1C(c2c(ccs2)n2c1nnc2SCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4131 |
| logD: | 4.4131 |
| logSw: | -4.3848 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.961 |
| InChI Key: | AGAOQLJSVGWOGY-UHFFFAOYSA-N |