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3-thiophenecarboxylic acid, 2-[[[6-cyclopropyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetyl]amino]-5-methyl-, methyl ester

View entire compound with spectra: 1 NMR

3-thiophenecarboxylic acid, 2-[[[6-cyclopropyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetyl]amino]-5-methyl-, methyl ester
SpectraBase Compound ID DCSjdytNGXo
InChI InChI=1S/C20H19F3N4O3S/c1-9-6-12(19(29)30-3)18(31-9)25-15(28)8-27-17-16(10(2)26-27)13(20(21,22)23)7-14(24-17)11-4-5-11/h6-7,11H,4-5,8H2,1-3H3,(H,25,28)
InChIKey QHJOGNWFTJTIIW-UHFFFAOYSA-N
Mol Weight 452.45 g/mol
Molecular Formula C20H19F3N4O3S
Exact Mass 452.112996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EWYWFg321BD
Name 3-thiophenecarboxylic acid, 2-[[[6-cyclopropyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetyl]amino]-5-methyl-, methyl ester
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/C20H19F3N4O3S/c1-9-6-12(19(29)30-3)18(31-9)25-15(28)8-27-17-16(10(2)26-27)13(20(21,22)23)7-14(24-17)11-4-5-11/h6-7,11H,4-5,8H2,1-3H3,(H,25,28)
InChIKey QHJOGNWFTJTIIW-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21464
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: 2180009; UZI_ID: UZI-021472
Temperature 298 °C