N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(1,4-dioxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methyl]-4-methoxybenzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(1,4-dioxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methyl]-4-methoxybenzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(1,4-dioxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methyl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | E220-1386 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(1,4-dioxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methyl]-4-methoxybenzamide |
| Molecular Weight: | 451.48 |
| Molecular Formula: | C24 H25 N3 O6 |
| Smiles: | COc1ccc(cc1CN1CC(N2CCCC2C1=O)=O)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3041 |
| logD: | 1.3041 |
| logSw: | -2.2434 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.828 |
| InChI Key: | GHMWIFABISRLEY-SFHVURJKSA-N |