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7-(difluoromethyl)-N-[4-(hexahydro-1H-azepin-1-ylsulfonyl)phenyl]-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

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7-(difluoromethyl)-N-[4-(hexahydro-1H-azepin-1-ylsulfonyl)phenyl]-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID HYw00rqxyEP
InChI InChI=1S/C27H27F2N5O3S/c1-18-6-8-19(9-7-18)23-16-24(25(28)29)34-26(32-23)22(17-30-34)27(35)31-20-10-12-21(13-11-20)38(36,37)33-14-4-2-3-5-15-33/h6-13,16-17,25H,2-5,14-15H2,1H3,(H,31,35)
InChIKey QFMDNKZXBGYKAM-UHFFFAOYSA-N
Mol Weight 539.6 g/mol
Molecular Formula C27H27F2N5O3S
Exact Mass 539.180267 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DT6bqL44UVJ
Name 7-(difluoromethyl)-N-[4-(hexahydro-1H-azepin-1-ylsulfonyl)phenyl]-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
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/C27H27F2N5O3S/c1-18-6-8-19(9-7-18)23-16-24(25(28)29)34-26(32-23)22(17-30-34)27(35)31-20-10-12-21(13-11-20)38(36,37)33-14-4-2-3-5-15-33/h6-13,16-17,25H,2-5,14-15H2,1H3,(H,31,35)
InChIKey QFMDNKZXBGYKAM-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3844
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: 9317918; UBI_ID: UBI-003845
Temperature 308 °C