2-(2-methyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-(2-methyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)-N-[(thiophen-2-yl)methyl]acetamide
2-(2-methyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | SD18-0157 |
| Compound Name: | 2-(2-methyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)-N-[(thiophen-2-yl)methyl]acetamide |
| Molecular Weight: | 308.36 |
| Molecular Formula: | C13 H16 N4 O3 S |
| Smiles: | CN1C(N2CCOC(CC(NCc3cccs3)=O)C2=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.655 |
| logD: | 0.654 |
| logSw: | -1.8717 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.087 |
| InChI Key: | FDFBVLDHKGVQBU-JTQLQIEISA-N |