3-(2H-1,3-benzodioxol-5-yl)-N-[2-(3,4-diethoxyphenyl)ethyl]-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)propanamide
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-N-[2-(3,4-diethoxyphenyl)ethyl]-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)propanamide
3-(2H-1,3-benzodioxol-5-yl)-N-[2-(3,4-diethoxyphenyl)ethyl]-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)propanamide
Compound characteristics
| Compound ID: | 8020-8566 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-N-[2-(3,4-diethoxyphenyl)ethyl]-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)propanamide |
| Molecular Weight: | 509.56 |
| Molecular Formula: | C28 H31 N O8 |
| Smiles: | CCOc1ccc(CCNC(CC(C2=C(C=C(C)OC2=O)O)c2ccc3c(c2)OCO3)=O)cc1OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5271 |
| logD: | -0.4646 |
| logSw: | -2.8746 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.448 |
| InChI Key: | OMLDMTDWGFXSRT-FQEVSTJZSA-N |