1-(2H-1,3-benzodioxol-5-yl)-4-oxo-4-(3,4,5-trimethoxyphenyl)butan-2-yl acetate
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-4-oxo-4-(3,4,5-trimethoxyphenyl)butan-2-yl acetate
1-(2H-1,3-benzodioxol-5-yl)-4-oxo-4-(3,4,5-trimethoxyphenyl)butan-2-yl acetate
Compound characteristics
| Compound ID: | 8020-8728 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-4-oxo-4-(3,4,5-trimethoxyphenyl)butan-2-yl acetate |
| Molecular Weight: | 416.43 |
| Molecular Formula: | C22 H24 O8 |
| Smiles: | CC(=O)OC(CC(c1cc(c(c(c1)OC)OC)OC)=O)Cc1ccc2c(c1)OCO2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.353 |
| logD: | 3.353 |
| logSw: | -3.384 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.608 |
| InChI Key: | MCVLZWZLSDWPNG-MRXNPFEDSA-N |