2-[(4-fluorophenyl)methyl]-9-[(4-methylphenyl)acetyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-9-[(4-methylphenyl)acetyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
2-[(4-fluorophenyl)methyl]-9-[(4-methylphenyl)acetyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Compound characteristics
Compound ID: | SD68-0809 |
Compound Name: | 2-[(4-fluorophenyl)methyl]-9-[(4-methylphenyl)acetyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one |
Molecular Weight: | 409.5 |
Molecular Formula: | C24 H28 F N3 O2 |
Smiles: | Cc1ccc(CC(N2CCCN3CCN(Cc4ccc(cc4)F)C(C3C2)=O)=O)cc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.686 |
logD: | 2.6802 |
logSw: | -2.7059 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 36.208 |
InChI Key: | KTJRKIJSWBUDMD-QFIPXVFZSA-N |