2-benzyl-8-(2,5-difluorobenzoyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-benzyl-8-(2,5-difluorobenzoyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
2-benzyl-8-(2,5-difluorobenzoyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0337 |
| Compound Name: | 2-benzyl-8-(2,5-difluorobenzoyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 399.44 |
| Molecular Formula: | C22 H23 F2 N3 O2 |
| Smiles: | C1CN(CCN2CCN(Cc3ccccc3)C(C12)=O)C(c1cc(ccc1F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3994 |
| logD: | 2.3987 |
| logSw: | -3.0563 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.802 |
| InChI Key: | QNGGMOWDPONPLS-HXUWFJFHSA-N |