1-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(2-phenylpropyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
1-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(2-phenylpropyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(2-phenylpropyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F401-0416 |
| Compound Name: | 1-{[(3-methoxyphenyl)methyl]sulfanyl}-4-(2-phenylpropyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 462.59 |
| Molecular Formula: | C24 H22 N4 O2 S2 |
| Smiles: | CC(CN1C(c2c(ccs2)n2c1nnc2SCc1cccc(c1)OC)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6432 |
| logD: | 5.6432 |
| logSw: | -5.3924 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.874 |
| InChI Key: | PGNQDFWXVVGECQ-INIZCTEOSA-N |