(7S,9aS)-7-benzyl-2-(2-methoxyethyl)-8-(1H-pyrazole-3-carbonyl)hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
Chemical Structure Depiction of
(7S,9aS)-7-benzyl-2-(2-methoxyethyl)-8-(1H-pyrazole-3-carbonyl)hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
(7S,9aS)-7-benzyl-2-(2-methoxyethyl)-8-(1H-pyrazole-3-carbonyl)hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
Compound characteristics
| Compound ID: | S975-0524 |
| Compound Name: | (7S,9aS)-7-benzyl-2-(2-methoxyethyl)-8-(1H-pyrazole-3-carbonyl)hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione |
| Molecular Weight: | 411.46 |
| Molecular Formula: | C21 H25 N5 O4 |
| Smiles: | COCCN1CCN2C([C@H](Cc3ccccc3)N(C[C@H]2C1=O)C(c1cc[nH]n1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.5185 |
| logD: | 0.5185 |
| logSw: | -1.6661 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.874 |
| InChI Key: | TXUHTNQQZMLHIC-MSOLQXFVSA-N |