ChemDiv1_003834
butan-2-yl 4-(4-acetyloxy-3-ethoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: ChemDiv1_003834|Oprea1_125983|HMS597O06|SR-01000433441-1|butan-2-yl 4-[4-(acetyloxy)-3-ethoxyphenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|2-ethoxy-4-{7-(4-methoxyphenyl)-2-methyl-3-[(methylpropyl)oxycarbonyl]-5-oxo(4 -1,4,6,7,8-pentahydroquinolyl)}phenyl acetate|butan-2-yl 4-(4-acetyloxy-3-ethoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate|sec-butyl 4-(4-acetoxy-3-ethoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|SEC-BUTYL 4-[4-(ACETYLOXY)-3-ETHOXYPHENYL]-7-(4-METHOXYPHENYL)-2-METHYL-5-OXO-4,6,7,8-TETRAHYDRO-1H-QUINOLINE-3-CARBOXYLATE
| Molecular Formula | C32H37NO7 |
|---|---|
| Molecular Weight | 547.257 g/mol |
| LogP | 5.7225 |
| Topological Polar Surface Area | 100.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 547.257 |
| Monoisotopic Mass | 547.257 |
| Heavy Atoms | 40 |
| Complexity | 1355.819 |
Chemical Identifiers
| CAS Number | 345237-47-0 |
|---|---|
| SMILES | CCC(C)OC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OC(=O)C)OCC)C(=O)CC(C2)C4=CC=C(C=C4)OC)C |
Product Overview
ChemDiv1_003834 (CAS 345237-47-0), with molecular formula C32H37NO7 and molecular weight 547.257 g/mol. IUPAC: butan-2-yl 4-(4-acetyloxy-3-ethoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.