ethyl 2-amino-4-(2H-1,3-benzodioxol-5-yl)-1-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 2-amino-4-(2H-1,3-benzodioxol-5-yl)-1-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
ethyl 2-amino-4-(2H-1,3-benzodioxol-5-yl)-1-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8008-1227 |
| Compound Name: | ethyl 2-amino-4-(2H-1,3-benzodioxol-5-yl)-1-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 446.5 |
| Molecular Formula: | C26 H26 N2 O5 |
| Smiles: | CCOC(C1C(C2=C(CCCC2=O)N(C=1N)c1cccc(C)c1)c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.048 |
| logD: | 4.048 |
| logSw: | -4.2151 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.19 |
| InChI Key: | SKCLCZZJPPXVNI-JOCHJYFZSA-N |