8-[(benzyloxy)acetyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
8-[(benzyloxy)acetyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
8-[(benzyloxy)acetyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0903 |
| Compound Name: | 8-[(benzyloxy)acetyl]-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one |
| Molecular Weight: | 425.5 |
| Molecular Formula: | C24 H28 F N3 O3 |
| Smiles: | C1CN(CCN2CCN(Cc3ccc(cc3)F)C(C12)=O)C(COCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7823 |
| logD: | 1.7769 |
| logSw: | -1.9508 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.709 |
| InChI Key: | QVTPNLWFCHCGHH-QFIPXVFZSA-N |