8-(3-fluoro-4-methylbenzoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
8-(3-fluoro-4-methylbenzoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
8-(3-fluoro-4-methylbenzoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0838 |
| Compound Name: | 8-(3-fluoro-4-methylbenzoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C24 H26 F N3 O3 |
| Smiles: | Cc1cccc(CN2CC(N3CCN(CCC3C2=O)C(c2ccc(C)c(c2)F)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5754 |
| logD: | 2.5754 |
| logSw: | -2.5474 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.09 |
| InChI Key: | ZZJQNZGTFXLTOJ-OAQYLSRUSA-N |