2-[(3-fluorophenyl)methyl]-8-(pyridine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-[(3-fluorophenyl)methyl]-8-(pyridine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
2-[(3-fluorophenyl)methyl]-8-(pyridine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0460 |
| Compound Name: | 2-[(3-fluorophenyl)methyl]-8-(pyridine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 396.42 |
| Molecular Formula: | C21 H21 F N4 O3 |
| Smiles: | C1CN(CCN2C1C(N(CC2=O)Cc1cccc(c1)F)=O)C(c1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2165 |
| logD: | 0.2141 |
| logSw: | -0.8598 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.518 |
| InChI Key: | HCQQTGHOCIKPPP-SFHVURJKSA-N |