(7S,9aS)-8-(2,5-dimethoxybenzene-1-sulfonyl)-2-(2-methoxyethyl)-7-methylhexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
Chemical Structure Depiction of
(7S,9aS)-8-(2,5-dimethoxybenzene-1-sulfonyl)-2-(2-methoxyethyl)-7-methylhexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
(7S,9aS)-8-(2,5-dimethoxybenzene-1-sulfonyl)-2-(2-methoxyethyl)-7-methylhexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
Compound characteristics
| Compound ID: | S975-0331 |
| Compound Name: | (7S,9aS)-8-(2,5-dimethoxybenzene-1-sulfonyl)-2-(2-methoxyethyl)-7-methylhexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C19 H27 N3 O7 S |
| Smiles: | C[C@H]1C(N2CCN(CCOC)C([C@@H]2CN1S(c1cc(ccc1OC)OC)(=O)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.0441 |
| logD: | 0.0441 |
| logSw: | -2.2134 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 88.196 |
| InChI Key: | VDBXJYCLMGJPJH-DZGCQCFKSA-N |