5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-hydroxy-4-(3-methoxybenzoyl)-1-[(oxolan-2-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-hydroxy-4-(3-methoxybenzoyl)-1-[(oxolan-2-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-hydroxy-4-(3-methoxybenzoyl)-1-[(oxolan-2-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 8020-7146 |
| Compound Name: | 5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-hydroxy-4-(3-methoxybenzoyl)-1-[(oxolan-2-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 497.5 |
| Molecular Formula: | C26 H27 N O9 |
| Smiles: | COc1cccc(c1)C(C1C(c2cc(c3c(c2OC)OCO3)OC)N(CC2CCCO2)C(C=1O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4566 |
| logD: | 2.4549 |
| logSw: | -2.9262 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.856 |
| InChI Key: | YBPQSJLXXQYGDW-UHFFFAOYSA-N |