2-[7-(4-fluorophenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[7-(4-fluorophenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-(4-methoxyphenyl)acetamide
2-[7-(4-fluorophenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | L386-0505 |
| Compound Name: | 2-[7-(4-fluorophenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 449.46 |
| Molecular Formula: | C22 H16 F N5 O3 S |
| Smiles: | COc1ccc(cc1)NC(CN1C(N2C=Nc3c(csc3C2=N1)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8897 |
| logD: | 3.8897 |
| logSw: | -4.1535 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.875 |
| InChI Key: | CCAYKKLZZYDZAB-UHFFFAOYSA-N |