2-benzyl-8-(4-chloro-2-methoxybenzoyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-benzyl-8-(4-chloro-2-methoxybenzoyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
2-benzyl-8-(4-chloro-2-methoxybenzoyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-1012 |
| Compound Name: | 2-benzyl-8-(4-chloro-2-methoxybenzoyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 441.91 |
| Molecular Formula: | C23 H24 Cl N3 O4 |
| Smiles: | COc1cc(ccc1C(N1CCC2C(N(CC(N2CC1)=O)Cc1ccccc1)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3387 |
| logD: | 2.3387 |
| logSw: | -3.2816 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.721 |
| InChI Key: | HSSSWLLQYRXDOB-LJQANCHMSA-N |