8-[(3-methylphenyl)acetyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
8-[(3-methylphenyl)acetyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
8-[(3-methylphenyl)acetyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0099 |
| Compound Name: | 8-[(3-methylphenyl)acetyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 301.39 |
| Molecular Formula: | C17 H23 N3 O2 |
| Smiles: | Cc1cccc(CC(N2CCC3C(NCCN3CC2)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1088 |
| logD: | 1.0024 |
| logSw: | -1.822 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.929 |
| InChI Key: | DLMGLKQRDPTRCA-HNNXBMFYSA-N |