8-(2-ethylbutanoyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
8-(2-ethylbutanoyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
8-(2-ethylbutanoyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0412 |
| Compound Name: | 8-(2-ethylbutanoyl)-2-[(3-fluorophenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C21 H28 F N3 O3 |
| Smiles: | CCC(CC)C(N1CCC2C(N(CC(N2CC1)=O)Cc1cccc(c1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0181 |
| logD: | 2.0181 |
| logSw: | -2.2334 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.362 |
| InChI Key: | KVFNHDKIVKJKDW-SFHVURJKSA-N |