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N-benzyl-4-[(2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydro-3(2H)-quinazolinyl)methyl]cyclohexanecarboxamide

View entire compound with spectra: 1 NMR

N-benzyl-4-[(2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydro-3(2H)-quinazolinyl)methyl]cyclohexanecarboxamide
SpectraBase Compound ID 4811zz0tWMO
InChI InChI=1S/C32H31N5O4/c38-29-18-25(34-28-12-6-7-17-35(28)29)21-36-27-11-5-4-10-26(27)31(40)37(32(36)41)20-23-13-15-24(16-14-23)30(39)33-19-22-8-2-1-3-9-22/h1-12,17-18,23-24H,13-16,19-21H2,(H,33,39)
InChIKey JCJLORUFZXLBNT-UHFFFAOYSA-N
Mol Weight 549.6 g/mol
Molecular Formula C32H31N5O4
Exact Mass 549.237604 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5HIXb4kVfS2
Name N-benzyl-4-[(2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydro-3(2H)-quinazolinyl)methyl]cyclohexanecarboxamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 549.237604494 u
Formula C32H31N5O4
InChI InChI=1S/C32H31N5O4/c38-29-18-25(34-28-12-6-7-17-35(28)29)21-36-27-11-5-4-10-26(27)31(40)37(32(36)41)20-23-13-15-24(16-14-23)30(39)33-19-22-8-2-1-3-9-22/h1-12,17-18,23-24H,13-16,19-21H2,(H,33,39)
InChIKey JCJLORUFZXLBNT-UHFFFAOYSA-N
Molecular Weight 549.631 g/mol
NMR Offset 18.0158
NMR Spectrometer Frequency 500.136
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9386
Solvent DMSO-d6
Source Vendor ID: NMR/13229260