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7-methoxy-4-(4-phenyl-1-piperazinyl)-5H-pyrimido[5,4-b]indole

View entire compound with spectra: 1 NMR

7-methoxy-4-(4-phenyl-1-piperazinyl)-5H-pyrimido[5,4-b]indole
SpectraBase Compound ID 2qjD7fsZ8jx
InChI InChI=1S/C21H21N5O/c1-27-16-7-8-17-18(13-16)24-20-19(17)22-14-23-21(20)26-11-9-25(10-12-26)15-5-3-2-4-6-15/h2-8,13-14,24H,9-12H2,1H3
InChIKey VXMLICDLLKQMPA-UHFFFAOYSA-N
Mol Weight 359.43 g/mol
Molecular Formula C21H21N5O
Exact Mass 359.17461 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Itfxu2Uv1NA
Name 7-methoxy-4-(4-phenyl-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/C21H21N5O/c1-27-16-7-8-17-18(13-16)24-20-19(17)22-14-23-21(20)26-11-9-25(10-12-26)15-5-3-2-4-6-15/h2-8,13-14,24H,9-12H2,1H3
InChIKey VXMLICDLLKQMPA-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6227
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: D13697; Labnumber: SIMAK-01215; SBI_ID: SBI-006230
Synonyms methyl 4-(4-phenyl-1-piperazinyl)-5H-pyrimido[5,4-b]indol-7-yl ether
Temperature 308 °C