(7S,9aS)-7-benzyl-2-(2-methoxyethyl)-8-[(4-methylphenyl)acetyl]hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
Chemical Structure Depiction of
(7S,9aS)-7-benzyl-2-(2-methoxyethyl)-8-[(4-methylphenyl)acetyl]hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
(7S,9aS)-7-benzyl-2-(2-methoxyethyl)-8-[(4-methylphenyl)acetyl]hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
Compound characteristics
| Compound ID: | S975-1030 |
| Compound Name: | (7S,9aS)-7-benzyl-2-(2-methoxyethyl)-8-[(4-methylphenyl)acetyl]hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C26 H31 N3 O4 |
| Smiles: | Cc1ccc(CC(N2C[C@H]3C(N(CCN3C([C@@H]2Cc2ccccc2)=O)CCOC)=O)=O)cc1 |
| Stereo: | ABSOLUTE |
| logP: | 2.4722 |
| logD: | 2.4722 |
| logSw: | -2.5191 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.745 |
| InChI Key: | OVXKYEUPMROUAI-PKTZIBPZSA-N |