2-[(4-fluorophenyl)methyl]-9-[(3-methoxyphenyl)acetyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-9-[(3-methoxyphenyl)acetyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
2-[(4-fluorophenyl)methyl]-9-[(3-methoxyphenyl)acetyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | SD68-0804 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-9-[(3-methoxyphenyl)acetyl]octahydropyrazino[1,2-a][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 425.5 |
| Molecular Formula: | C24 H28 F N3 O3 |
| Smiles: | COc1cccc(CC(N2CCCN3CCN(Cc4ccc(cc4)F)C(C3C2)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3635 |
| logD: | 2.3577 |
| logSw: | -2.6113 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.752 |
| InChI Key: | YAOJPQMXBSFCEK-QFIPXVFZSA-N |