N-(3-acetylphenyl)-2-[(4-benzyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-[(4-benzyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide
N-(3-acetylphenyl)-2-[(4-benzyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F798-0433 |
| Compound Name: | N-(3-acetylphenyl)-2-[(4-benzyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C24 H19 N5 O3 S2 |
| Smiles: | CC(c1cccc(c1)NC(CSc1nnc2N(Cc3ccccc3)C(c3c(ccs3)n12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8484 |
| logD: | 3.8484 |
| logSw: | -3.9647 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.306 |
| InChI Key: | OTDFNKDGCOBTBL-UHFFFAOYSA-N |