3-[3-oxo-3-(thiomorpholin-4-yl)propyl]-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-[3-oxo-3-(thiomorpholin-4-yl)propyl]-1,2,3-benzotriazin-4(3H)-one
3-[3-oxo-3-(thiomorpholin-4-yl)propyl]-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | Y041-0016 |
| Compound Name: | 3-[3-oxo-3-(thiomorpholin-4-yl)propyl]-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 304.37 |
| Molecular Formula: | C14 H16 N4 O2 S |
| Smiles: | C(CN1C(c2ccccc2N=N1)=O)C(N1CCSCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9906 |
| logD: | 0.9906 |
| logSw: | -2.2073 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.304 |
| InChI Key: | ADAWJVAWUDYGLA-UHFFFAOYSA-N |