methyl 4-{3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 4-{3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 4-{3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | Y500-8383 |
| Compound Name: | methyl 4-{3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 467.95 |
| Molecular Formula: | C26 H26 Cl N O5 |
| Smiles: | CC1=C(C(C2=C(CCCC2=O)N1)c1ccc(c(COc2ccccc2[Cl])c1)OC)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5492 |
| logD: | 0.6534 |
| logSw: | -4.6976 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.04 |
| InChI Key: | QKPMINYKQYRTLL-DEOSSOPVSA-N |