3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N-[(3-ethoxy-4-methoxyphenyl)methyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)propanamide
Chemical Structure Depiction of
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N-[(3-ethoxy-4-methoxyphenyl)methyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)propanamide
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N-[(3-ethoxy-4-methoxyphenyl)methyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)propanamide
Compound characteristics
| Compound ID: | 8020-8479 |
| Compound Name: | 3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N-[(3-ethoxy-4-methoxyphenyl)methyl]-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)propanamide |
| Molecular Weight: | 577.59 |
| Molecular Formula: | C31 H31 N O10 |
| Smiles: | CCOc1cc(CNC(CC(C2=C(c3ccccc3OC2=O)O)c2cc(c3c(c2OC)OCO3)OC)=O)ccc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6755 |
| logD: | 0.1565 |
| logSw: | -3.2996 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.832 |
| InChI Key: | SRURIRPXRFGLSU-IBGZPJMESA-N |