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6-BROMO-3-[[5-(2-CHLORO-PHENYL)-1,3,4-OXADIAZOL-2-YL]-METHYL]-2-[2-[(2,6-DICHLORO-PHENYL)-AMINO]-BENZYL]-QUINAZOLIN-4(3H)-ONE

View entire compound with spectra: 1 NMR

6-BROMO-3-[[5-(2-CHLORO-PHENYL)-1,3,4-OXADIAZOL-2-YL]-METHYL]-2-[2-[(2,6-DICHLORO-PHENYL)-AMINO]-BENZYL]-QUINAZOLIN-4(3H)-ONE
SpectraBase Compound ID 4fc18nFcGpJ
InChI InChI=1S/C30H19BrCl3N5O2/c31-18-12-13-25-20(15-18)30(40)39(16-27-37-38-29(41-27)19-7-2-3-8-21(19)32)26(35-25)14-17-6-1-4-11-24(17)36-28-22(33)9-5-10-23(28)34/h1-13,15,36H,14,16H2
InChIKey BFPGMFFFNAGVTD-UHFFFAOYSA-N
Mol Weight 667.78 g/mol
Molecular Formula C30H19BrCl3N5O2
Exact Mass 664.978771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JZdOtarb2WV
Name 6-BROMO-3-[[5-(2-CHLORO-PHENYL)-1,3,4-OXADIAZOL-2-YL]-METHYL]-2-[2-[(2,6-DICHLORO-PHENYL)-AMINO]-BENZYL]-QUINAZOLIN-4(3H)-ONE
Compound Number 12B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H19BrCl3N5O2
InChI InChI=1S/C30H19BrCl3N5O2/c31-18-12-13-25-20(15-18)30(40)39(16-27-37-38-29(41-27)19-7-2-3-8-21(19)32)26(35-25)14-17-6-1-4-11-24(17)36-28-22(33)9-5-10-23(28)34/h1-13,15,36H,14,16H2
InChIKey BFPGMFFFNAGVTD-UHFFFAOYSA-N
Literature Reference Author N.B.PATEL,J.C.PATEL
Literature Reference Citation SCI.PHARM.,78,171(2010)
Literature Reference DOI 10.3797/scipharm.0912-16
Molecular Weight 667.776 g/mol
Sample ID 3011
Solvent DMSO-D6