2-[(4-fluorophenyl)methyl]-8-[(2-methylphenyl)acetyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-8-[(2-methylphenyl)acetyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
2-[(4-fluorophenyl)methyl]-8-[(2-methylphenyl)acetyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0872 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-8-[(2-methylphenyl)acetyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 409.5 |
| Molecular Formula: | C24 H28 F N3 O2 |
| Smiles: | Cc1ccccc1CC(N1CCC2C(N(CCN2CC1)Cc1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9899 |
| logD: | 2.9841 |
| logSw: | -2.9064 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.275 |
| InChI Key: | ZCCMCFWTAQAOPS-QFIPXVFZSA-N |