N-(3-chlorophenyl)-2-[7-(4-methylphenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-[7-(4-methylphenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(3-chlorophenyl)-2-[7-(4-methylphenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | L386-0238 |
| Compound Name: | N-(3-chlorophenyl)-2-[7-(4-methylphenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 449.92 |
| Molecular Formula: | C22 H16 Cl N5 O2 S |
| Smiles: | Cc1ccc(cc1)c1csc2C3=NN(CC(Nc4cccc(c4)[Cl])=O)C(N3C=Nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0552 |
| logD: | 5.0552 |
| logSw: | -5.0566 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.332 |
| InChI Key: | RXGPJRSHOZOJNI-UHFFFAOYSA-N |