methyl 4-(4-ethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 4-(4-ethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 4-(4-ethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 1630-1176 |
| Compound Name: | methyl 4-(4-ethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 353.46 |
| Molecular Formula: | C22 H27 N O3 |
| Smiles: | CCc1ccc(cc1)C1C(=C(C)NC2CC(C)(C)CC(C1=2)=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3147 |
| logD: | 0.0276 |
| logSw: | -4.4357 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.095 |
| InChI Key: | GQQRHQCOHLRROV-IBGZPJMESA-N |