3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
Chemical Structure Depiction of
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
Compound characteristics
| Compound ID: | 8020-8372 |
| Compound Name: | 3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-(3,4,5-trimethoxyphenyl)propanamide |
| Molecular Weight: | 543.53 |
| Molecular Formula: | C27 H29 N O11 |
| Smiles: | CC1=CC(=C(C(CC(Nc2cc(c(c(c2)OC)OC)OC)=O)c2cc(c3c(c2OC)OCO3)OC)C(=O)O1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1066 |
| logD: | -0.8851 |
| logSw: | -2.7486 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.558 |
| InChI Key: | JNGCQZSYWVBFCA-HNNXBMFYSA-N |