2-(2-benzyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-(2-benzyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide
2-(2-benzyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | SD18-0336 |
| Compound Name: | 2-(2-benzyl-3-oxo-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-8-yl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C22 H32 N6 O3 |
| Smiles: | CCN1CCN(CCNC(CC2C3=NN(Cc4ccccc4)C(N3CCO2)=O)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4268 |
| logD: | -0.3658 |
| logSw: | -1.8916 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.478 |
| InChI Key: | WZLYPRCMRLMRCN-IBGZPJMESA-N |