N-(3-chloro-4-methoxyphenyl)-2-[7-(4-fluorophenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[7-(4-fluorophenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(3-chloro-4-methoxyphenyl)-2-[7-(4-fluorophenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | L386-0471 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[7-(4-fluorophenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 483.91 |
| Molecular Formula: | C22 H15 Cl F N5 O3 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CN1C(N2C=Nc3c(csc3C2=N1)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.418 |
| logD: | 4.4179 |
| logSw: | -4.5909 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.962 |
| InChI Key: | QILNWPPNLCTAFW-UHFFFAOYSA-N |