2-benzyl-8-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-one
Chemical Structure Depiction of
2-benzyl-8-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-one
2-benzyl-8-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-one
Compound characteristics
| Compound ID: | SD18-0394 |
| Compound Name: | 2-benzyl-8-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-one |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C26 H30 N4 O3 |
| Smiles: | C1CN(CCC1Cc1ccccc1)C(CC1C2=NN(Cc3ccccc3)C(N2CCO1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8167 |
| logD: | 3.8156 |
| logSw: | -4.0527 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.767 |
| InChI Key: | QGRBKPXGPWLWBV-QHCPKHFHSA-N |