(7S,9aS)-7-benzyl-8-(3,4-dimethylbenzoyl)-2-(2-methoxyethyl)hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
Chemical Structure Depiction of
(7S,9aS)-7-benzyl-8-(3,4-dimethylbenzoyl)-2-(2-methoxyethyl)hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
(7S,9aS)-7-benzyl-8-(3,4-dimethylbenzoyl)-2-(2-methoxyethyl)hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
Compound characteristics
| Compound ID: | S975-1025 |
| Compound Name: | (7S,9aS)-7-benzyl-8-(3,4-dimethylbenzoyl)-2-(2-methoxyethyl)hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C26 H31 N3 O4 |
| Smiles: | Cc1ccc(cc1C)C(N1C[C@H]2C(N(CCN2C([C@@H]1Cc1ccccc1)=O)CCOC)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8681 |
| logD: | 2.8681 |
| logSw: | -3.0816 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.272 |
| InChI Key: | FSPBKLKLLASHBT-PKTZIBPZSA-N |