N-(4-acetylphenyl)-2-(6-ethyl-6-methyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-3(6H)-yl)acetamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-2-(6-ethyl-6-methyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-3(6H)-yl)acetamide
N-(4-acetylphenyl)-2-(6-ethyl-6-methyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-3(6H)-yl)acetamide
Compound characteristics
| Compound ID: | 8640-0248 |
| Compound Name: | N-(4-acetylphenyl)-2-(6-ethyl-6-methyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-3(6H)-yl)acetamide |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C21 H22 N4 O4 S |
| Smiles: | [H]N(C(CN1C(c2c3CC(C)(CC)OCc3sc2N=N1)=O)=O)c1ccc(cc1)C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3675 |
| logD: | 3.3674 |
| logSw: | -3.5893 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.623 |
| InChI Key: | MOSZJAVPHSWNFL-NRFANRHFSA-N |