1-{[(3-methoxyphenyl)methyl]sulfanyl}-4-{[4-(propan-2-yl)phenyl]methyl}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-{[4-(propan-2-yl)phenyl]methyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-{[(3-methoxyphenyl)methyl]sulfanyl}-4-{[4-(propan-2-yl)phenyl]methyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | C200-7219 |
| Compound Name: | 1-{[(3-methoxyphenyl)methyl]sulfanyl}-4-{[4-(propan-2-yl)phenyl]methyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 476.62 |
| Molecular Formula: | C25 H24 N4 O2 S2 |
| Smiles: | CC(C)c1ccc(CN2C(c3c(ccs3)n3c2nnc3SCc2cccc(c2)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.1032 |
| logD: | 6.1032 |
| logSw: | -5.4621 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.874 |
| InChI Key: | WZIIATVEVYKOBY-UHFFFAOYSA-N |