5-(4-chlorobenzyl)-2-(4,6-dimethyl-2-pyrimidinyl)-6-methyl-1H-pyrazolo[3,4-b]pyridine-3,4(2H,7H)-dione

SpectraBase Compound ID	9cbjBnSZkWR
InChI	InChI=1S/C20H18ClN5O2/c1-10-8-11(2)23-20(22-10)26-19(28)16-17(27)15(12(3)24-18(16)25-26)9-13-4-6-14(21)7-5-13/h4-8H,9H2,1-3H3,(H2,24,25,27)
InChIKey	KCRSBDCWGKCRRB-UHFFFAOYSA-N Google Search
Mol Weight	395.85 g/mol
Molecular Formula	C20H18ClN5O2
Exact Mass	395.114903 g/mol

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SpectraBase Spectrum ID	HM0LrJxKKcx
Name	5-(4-chlorobenzyl)-2-(4,6-dimethyl-2-pyrimidinyl)-6-methyl-1H-pyrazolo[3,4-b]pyridine-3,4(2H,7H)-dione
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/C20H18ClN5O2/c1-10-8-11(2)23-20(22-10)26-19(28)16-17(27)15(12(3)24-18(16)25-26)9-13-4-6-14(21)7-5-13/h4-8H,9H2,1-3H3,(H2,24,25,27)
InChIKey	KCRSBDCWGKCRRB-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_35175
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: E83508; SBI_ID: SBI-035179
Temperature	298 °C