2-[(4-fluorophenyl)methyl]-8-(3-fluoropyridine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-8-(3-fluoropyridine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
2-[(4-fluorophenyl)methyl]-8-(3-fluoropyridine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0824 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-8-(3-fluoropyridine-4-carbonyl)octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 400.43 |
| Molecular Formula: | C21 H22 F2 N4 O2 |
| Smiles: | C1CN(CCN2CCN(Cc3ccc(cc3)F)C(C12)=O)C(c1ccncc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2238 |
| logD: | 1.223 |
| logSw: | -1.6587 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.32 |
| InChI Key: | KPCOTTFKXPDRBJ-LJQANCHMSA-N |