N-[(2,3-dimethoxyphenyl)methyl]-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-[(2,3-dimethoxyphenyl)methyl]-2-[7-(4-methylphenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-[(2,3-dimethoxyphenyl)methyl]-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: | L386-0303 |
| Compound Name: | N-[(2,3-dimethoxyphenyl)methyl]-2-[7-(4-methylphenyl)-3-oxothieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 489.55 |
| Molecular Formula: | C25 H23 N5 O4 S |
| Smiles: | Cc1ccc(cc1)c1csc2C3=NN(CC(NCc4cccc(c4OC)OC)=O)C(N3C=Nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0204 |
| logD: | 4.0203 |
| logSw: | -4.2875 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.001 |
| InChI Key: | CTOAKGXLGYXKLU-UHFFFAOYSA-N |