N-[2-(3,4-diethoxyphenyl)ethyl]-4-[(1,4-dioxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-4-[(1,4-dioxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methyl]benzamide
N-[2-(3,4-diethoxyphenyl)ethyl]-4-[(1,4-dioxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methyl]benzamide
Compound characteristics
| Compound ID: | E220-0207 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-4-[(1,4-dioxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methyl]benzamide |
| Molecular Weight: | 479.58 |
| Molecular Formula: | C27 H33 N3 O5 |
| Smiles: | CCOc1ccc(CCNC(c2ccc(CN3CC(N4CCCC4C3=O)=O)cc2)=O)cc1OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9882 |
| logD: | 0.9882 |
| logSw: | -2.2669 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.344 |
| InChI Key: | XDLJVHYOOOFXFG-QFIPXVFZSA-N |