ethyl 4-{5-[(4-bromophenoxy)methyl]furan-2-yl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{5-[(4-bromophenoxy)methyl]furan-2-yl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
ethyl 4-{5-[(4-bromophenoxy)methyl]furan-2-yl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | Y500-7514 |
| Compound Name: | ethyl 4-{5-[(4-bromophenoxy)methyl]furan-2-yl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 514.42 |
| Molecular Formula: | C26 H28 Br N O5 |
| Smiles: | CCOC(C1C(C2=C(CC(C)(C)CC2=O)NC=1C)c1ccc(COc2ccc(cc2)[Br])o1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7775 |
| logD: | 1.3379 |
| logSw: | -5.5909 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.744 |
| InChI Key: | HAEZTTWZUHBQGE-DEOSSOPVSA-N |