Oprea1_258528
ethyl 4-[4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: Oprea1_258528|AK-968/15342062|ethyl 4-{4-[(3-chlorobenzyl)oxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate|ethyl 4-[4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate|ethyl 4-{4-[(3-chlorobenzyl)oxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|ethyl 4-{4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1, 4,6,7,8-pentahydroquinoline-3-carboxylate
| Molecular Formula | C29H32ClNO5 |
|---|---|
| Molecular Weight | 509.1969 g/mol |
| LogP | 6.0947 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 509.1969 |
| Monoisotopic Mass | 509.1969 |
| Heavy Atoms | 36 |
| Complexity | 1260.0609 |
Chemical Identifiers
| CAS Number | 397875-10-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OCC4=CC(=CC=C4)Cl)OC)C(=O)CC(C2)(C)C)C |
Product Overview
Oprea1_258528 (CAS 397875-10-4), with molecular formula C29H32ClNO5 and molecular weight 509.1969 g/mol. IUPAC: ethyl 4-[4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.