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N-(4-methoxyphenyl)-2-{4-[(4-methylphenyl)sulfonyl]-1-piperazinyl}-4-quinazolinamine
SpectraBase Compound ID I16qrwvTCbm
InChI InChI=1S/C26H27N5O3S/c1-19-7-13-22(14-8-19)35(32,33)31-17-15-30(16-18-31)26-28-24-6-4-3-5-23(24)25(29-26)27-20-9-11-21(34-2)12-10-20/h3-14H,15-18H2,1-2H3,(H,27,28,29)
InChIKey XSLJHBKAFRIILX-UHFFFAOYSA-N
Mol Weight 489.59 g/mol
Molecular Formula C26H27N5O3S
Exact Mass 489.183461 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IAIIrUZuYN7
Name N-(4-methoxyphenyl)-2-{4-[(4-methylphenyl)sulfonyl]-1-piperazinyl}-4-quinazolinamine
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C26H27N5O3S/c1-19-7-13-22(14-8-19)35(32,33)31-17-15-30(16-18-31)26-28-24-6-4-3-5-23(24)25(29-26)27-20-9-11-21(34-2)12-10-20/h3-14H,15-18H2,1-2H3,(H,27,28,29)
InChIKey XSLJHBKAFRIILX-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_24300
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D46428; Labnumber: SPKUZ-2449; SBI_ID: SBI-024304
Synonyms N-(4-methoxyphenyl)-N-(2-{4-[(4-methylphenyl)sulfonyl]-1-piperazinyl}-4-quinazolinyl)amine
Temperature 308 °C