3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-[2-(4-methoxyphenyl)ethyl]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-[2-(4-methoxyphenyl)ethyl]propanamide
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | 8020-8578 |
| Compound Name: | 3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-[2-(4-methoxyphenyl)ethyl]propanamide |
| Molecular Weight: | 511.53 |
| Molecular Formula: | C27 H29 N O9 |
| Smiles: | CC1=CC(=C(C(CC(NCCc2ccc(cc2)OC)=O)c2cc(c3c(c2OC)OCO3)OC)C(=O)O1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0988 |
| logD: | -0.8929 |
| logSw: | -3.1103 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.288 |
| InChI Key: | XIBAZQZUYJLCDY-SFHVURJKSA-N |