8-(3-cyclohexylpropanoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
8-(3-cyclohexylpropanoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
8-(3-cyclohexylpropanoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | S993-0797 |
| Compound Name: | 8-(3-cyclohexylpropanoyl)-2-[(3-methylphenyl)methyl]octahydropyrazino[1,2-d][1,4]diazepine-1,4-dione |
| Molecular Weight: | 425.57 |
| Molecular Formula: | C25 H35 N3 O3 |
| Smiles: | Cc1cccc(CN2CC(N3CCN(CCC3C2=O)C(CCC2CCCCC2)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2508 |
| logD: | 3.2508 |
| logSw: | -3.2454 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.755 |
| InChI Key: | OCEMPJUHBWOPIJ-QFIPXVFZSA-N |