N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-(2-ethyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)acetamide
Chemical Structure Depiction of
N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-(2-ethyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)acetamide
N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-(2-ethyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)acetamide
Compound characteristics
| Compound ID: | SD18-0250 |
| Compound Name: | N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-(2-ethyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)acetamide |
| Molecular Weight: | 427.55 |
| Molecular Formula: | C23 H33 N5 O3 |
| Smiles: | CCN1C(N2CCOC(CC(NCCN3CCC(CC3)Cc3ccccc3)=O)C2=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1386 |
| logD: | 0.958 |
| logSw: | -2.464 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.666 |
| InChI Key: | VGKXCOFPDMEADS-FQEVSTJZSA-N |