9-(3,4-dimethylbenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
9-(3,4-dimethylbenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
9-(3,4-dimethylbenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | SD68-0012 |
| Compound Name: | 9-(3,4-dimethylbenzoyl)octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 301.39 |
| Molecular Formula: | C17 H23 N3 O2 |
| Smiles: | Cc1ccc(cc1C)C(N1CCCN2CCNC(C2C1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0783 |
| logD: | 1.0631 |
| logSw: | -1.982 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.39 |
| InChI Key: | PRJDDLTYASVVBK-HNNXBMFYSA-N |