N-(3-acetylphenyl)-2-(4-butyl-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-(4-butyl-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl)acetamide
N-(3-acetylphenyl)-2-(4-butyl-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | L397-0449 |
| Compound Name: | N-(3-acetylphenyl)-2-(4-butyl-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl)acetamide |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C21 H21 N5 O4 S |
| Smiles: | CCCCN1C2=NN(CC(Nc3cccc(c3)C(C)=O)=O)C(N2c2ccsc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0298 |
| logD: | 3.0297 |
| logSw: | -3.3194 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.18 |
| InChI Key: | JZXFKNKDGDTDOX-UHFFFAOYSA-N |