methyl 7-(2H-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4-(2-propoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 7-(2H-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4-(2-propoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 7-(2H-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4-(2-propoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 2204-2906 |
| Compound Name: | methyl 7-(2H-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4-(2-propoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 475.54 |
| Molecular Formula: | C28 H29 N O6 |
| Smiles: | CCCOc1ccccc1C1C(=C(C)NC2CC(CC(C1=2)=O)c1ccc2c(c1)OCO2)C(=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6699 |
| logD: | 1.1896 |
| logSw: | -5.5102 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.443 |
| InChI Key: | GPQSGGHMXPFCSR-UHFFFAOYSA-N |