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8-methoxy-5-methyl-4-{4-[(2E)-3-phenyl-2-propenyl]-1-piperazinyl}-5H-pyrimido[5,4-b]indole
SpectraBase Compound ID 4hz3L58YvDD
InChI InChI=1S/C25H27N5O/c1-28-22-11-10-20(31-2)17-21(22)23-24(28)25(27-18-26-23)30-15-13-29(14-16-30)12-6-9-19-7-4-3-5-8-19/h3-11,17-18H,12-16H2,1-2H3/b9-6+
InChIKey MIAROHWVTNNDCL-RMKNXTFCSA-N
Mol Weight 413.53 g/mol
Molecular Formula C25H27N5O
Exact Mass 413.221561 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F9KsbU46PwP
Name 8-methoxy-5-methyl-4-{4-[(2E)-3-phenyl-2-propenyl]-1-piperazinyl}-5H-pyrimido[5,4-b]indole
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/C25H27N5O/c1-28-22-11-10-20(31-2)17-21(22)23-24(28)25(27-18-26-23)30-15-13-29(14-16-30)12-6-9-19-7-4-3-5-8-19/h3-11,17-18H,12-16H2,1-2H3/b9-6+
InChIKey MIAROHWVTNNDCL-RMKNXTFCSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14473
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: D99632; Labnumber: NC_0041-1520; SBI_ID: SBI-014476
Synonyms methyl 5-methyl-4-{4-[(2E)-3-phenyl-2-propenyl]-1-piperazinyl}-5H-pyrimido[5,4-b]indol-8-yl ether8-methoxy-5-methyl-4-{4-[3-phenyl-2-propenyl]-1-piperazinyl}-5H-pyrimido[5,4-b]indole
Temperature 308 °C