8-(2-ethoxybenzoyl)-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Chemical Structure Depiction of
8-(2-ethoxybenzoyl)-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
8-(2-ethoxybenzoyl)-2-[(4-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepin-1(2H)-one
Compound characteristics
| Compound ID: | S994-0815 |
| Compound Name: | 8-(2-ethoxybenzoyl)-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: | CCOc1ccccc1C(N1CCC2C(N(CCN2CC1)Cc1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2904 |
| logD: | 2.2896 |
| logSw: | -2.7441 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.013 |
| InChI Key: | RJBJXJIGJBAQLB-NRFANRHFSA-N |