N-[2-(4-chlorophenyl)ethyl]-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-[2-(4-chlorophenyl)ethyl]-2-[7-(4-fluorophenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-[2-(4-chlorophenyl)ethyl]-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: | L386-0545 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-[7-(4-fluorophenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 481.93 |
| Molecular Formula: | C23 H17 Cl F N5 O2 S |
| Smiles: | C(CNC(CN1C(N2C=Nc3c(csc3C2=N1)c1ccc(cc1)F)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8545 |
| logD: | 3.8543 |
| logSw: | -4.5401 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.495 |
| InChI Key: | CVYMDFNSOBJFQW-UHFFFAOYSA-N |