2-benzyl-8-[(thiophen-3-yl)acetyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-benzyl-8-[(thiophen-3-yl)acetyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
2-benzyl-8-[(thiophen-3-yl)acetyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0326 |
| Compound Name: | 2-benzyl-8-[(thiophen-3-yl)acetyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C21 H23 N3 O3 S |
| Smiles: | C1CN(CCN2C1C(N(CC2=O)Cc1ccccc1)=O)C(Cc1ccsc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3741 |
| logD: | 1.3741 |
| logSw: | -2.0646 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.581 |
| InChI Key: | IBLLOWNTBSDYFA-SFHVURJKSA-N |