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3-[(1R)-1-PHENYLETHYL]-6-CHLORO-4-(TRIFLUOROMETHYL)-3-HYDROQUINAZOLIN-2-ONE

Compound with spectra: 2 NMR

3-[(1R)-1-PHENYLETHYL]-6-CHLORO-4-(TRIFLUOROMETHYL)-3-HYDROQUINAZOLIN-2-ONE
SpectraBase Compound ID CtNvsOJEiPb
InChI InChI=1S/C17H12ClF3N2O.C6H15N.CHF3O3S/c1-10(11-5-3-2-4-6-11)23-15(17(19,20)21)13-9-12(18)7-8-14(13)22-16(23)24;1-4-7(5-2)6-3;2-1(3,4)8(5,6)7/h2-10H,1H3;4-6H2,1-3H3;(H,5,6,7)/t10-;;/m1../s1
InChIKey ATIADWZPZFCOFR-YQFADDPSSA-N
Mol Weight 604.01 g/mol
Molecular Formula C24H28ClF6N3O4S
Exact Mass 603.139324 g/mol
Parent InChIKey AELCTCZJKWGNDB-SNVBAGLBSA-N
Enantiomer InChIKey ATIADWZPZFCOFR-XRIOVQLTSA-N
Racemate InChIKey ATIADWZPZFCOFR-UHFFFAOYSA-N

View Spectrum of 3-[(1R)-1-PHENYLETHYL]-6-CHLORO-4-(TRIFLUOROMETHYL)-3-HYDROQUINAZOLIN-2-ONE

19F NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD2Cl2

View Spectrum of 3-[(1R)-1-PHENYLETHYL]-6-CHLORO-4-(TRIFLUOROMETHYL)-3-HYDROQUINAZOLIN-2-ONE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD2Cl2
4-[(1-[2-(4-ethoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]-N-(2-phenylethyl)cyclohexanecarboxamide
1-ACETYL-2-PHENYL-3-TERT.-BUTOXYCARBONYLAMINO-METHYLCARBONYL-AMINO-4-BENZOYL-1,2-DIHYDROPYRIDINE
1,3-diethyl-N-(2-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydro-6-quinazolinesulfonamide
8-Ethoxy-2,2-bis(trifluoromethyl)-2,3-dihydro-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one
Methyl 6a-cyano-1,3-dimethyl-2,4-dioxo-4a,5,6,6a-tetrahydrocyclobutapyrimidine-6-carboxylate
2,3:4,5-Bis-O-isopropylidene-.beta.-d-fructopyranose N-phenylcarbamate
1-(3-Methylphenyl)-3-[(3-methylphenyl)amino]-5,6-dihydro-4H-indol-2-one
9-Methoxy-2',2',7-trimethylspiro[benzo[7]annulene-6,1'-cyclopropan]-5(7H)-one
1-Deoxy-2,3:4,5-di-O-isopropylidene-1-thioacetamido-.beta.,D-fructopyranose
4-[(1-[2-(4-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]-N-(2-phenylethyl)cyclohexanecarboxamide
Title Journal or Book Year
General Scope of 1,4-Diastereoselective Additions to a 2(3H)-Quinazolinone:  Practical Preparation of HIV Therapeutics The Journal of Organic Chemistry 2002
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