AC1Q4AUE structure

AC1Q4AUE

2-phenylethyl 4-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Also Known As: CBMicro_032735|Oprea1_048253|Oprea1_827971|BAS 00915351|BIM-0032661.P001|AK-968/12121446|SR-01000419203-1|2-phenylethyl 4-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|2-PHENYLETHYL 4-(4-METHOXYPHENYL)-2-METHYL-5-OXO-4,6,7,8-TETRAHYDRO-1H-QUINOLINE-3-CARBOXYLATE|phenethyl 4-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|2-phenylethyl 4-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate|PHENETHYL 4-(4-METHOXYPHENYL)-2-METHYL-5-OXO-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBOXYLATE|phenethyl 4-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

CAS: 313244-95-0
Molecular Formula C26H27NO4
Molecular Weight 417.194 g/mol
LogP 4.449
Topological Polar Surface Area 64.63 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 417.194
Monoisotopic Mass 417.194
Heavy Atoms 31
Complexity 1034.8364

Chemical Identifiers

CAS Number 313244-95-0
SMILES CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)OC)C(=O)OCCC4=CC=CC=C4

Product Overview

AC1Q4AUE (CAS 313244-95-0), with molecular formula C26H27NO4 and molecular weight 417.194 g/mol. IUPAC: 2-phenylethyl 4-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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