1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3,4-dimethoxybenzoyl)-3-hydroxy-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3,4-dimethoxybenzoyl)-3-hydroxy-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3,4-dimethoxybenzoyl)-3-hydroxy-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 8020-7286 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3,4-dimethoxybenzoyl)-3-hydroxy-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 563.56 |
| Molecular Formula: | C30 H29 N O10 |
| Smiles: | COc1ccc(cc1OC)C(C1C(c2cc(c(c(c2)OC)OC)OC)N(Cc2ccc3c(c2)OCO3)C(C=1O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3406 |
| logD: | 3.337 |
| logSw: | -3.4246 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.181 |
| InChI Key: | CGYKCOSZKKJRBV-SANMLTNESA-N |