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3-[(4-benzyl-1-piperazinyl)carbonyl]-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine
SpectraBase Compound ID IrwBOZaSYqE
InChI InChI=1S/C26H25F2N5O/c1-18-7-9-20(10-8-18)22-15-23(24(27)28)33-25(30-22)21(16-29-33)26(34)32-13-11-31(12-14-32)17-19-5-3-2-4-6-19/h2-10,15-16,24H,11-14,17H2,1H3
InChIKey FGKOMOPGTBBFRQ-UHFFFAOYSA-N
Mol Weight 461.52 g/mol
Molecular Formula C26H25F2N5O
Exact Mass 461.202717 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6jQjkQL5Raf
Name 3-[(4-benzyl-1-piperazinyl)carbonyl]-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine
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/C26H25F2N5O/c1-18-7-9-20(10-8-18)22-15-23(24(27)28)33-25(30-22)21(16-29-33)26(34)32-13-11-31(12-14-32)17-19-5-3-2-4-6-19/h2-10,15-16,24H,11-14,17H2,1H3
InChIKey FGKOMOPGTBBFRQ-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3512
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: 9315181; UBI_ID: UBI-003513
Temperature 313 °C