1-(4-fluorophenyl)-7-(3-methylphenyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione

SpectraBase Compound ID	DYnpwDY3CTx
InChI	InChI=1S/C21H13F7N4O2/c1-10-3-2-4-11(9-10)15-29-16-14(19(31-15,20(23,24)25)21(26,27)28)17(33)30-18(34)32(16)13-7-5-12(22)6-8-13/h2-9H,1H3,(H,29,31)(H,30,33,34)
InChIKey	BRBFGWMPLCCHKY-UHFFFAOYSA-N Google Search
Mol Weight	486.35 g/mol
Molecular Formula	C21H13F7N4O2
Exact Mass	486.092673 g/mol

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SpectraBase Spectrum ID	lYKrviq4aw
Name	1-(4-Fluoro-phenyl)-7-m-tolyl-5,5-bis-trifluoromethyl-5,8-dihydro-1H-pyrimido[4,5-d]pyrimidine-2,4-dione
Alternate Name(s)	1-(4-Fluorophenyl)-7-(3-methylphenyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione 1-(4-fluorophenyl)-7-(3-methylphenyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 1-(4-fluorophenyl)-7-(m-tolyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione 1-(4-fluorophenyl)-7-(m-tolyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H13F7N4O2
InChI	InChI=1S/C21H13F7N4O2/c1-10-3-2-4-11(9-10)15-29-16-14(19(31-15,20(23,24)25)21(26,27)28)17(33)30-18(34)32(16)13-7-5-12(22)6-8-13/h2-9H,1H3,(H,29,31)(H,30,33,34)
InChIKey	BRBFGWMPLCCHKY-UHFFFAOYSA-N
Molecular Weight	486.350 g/mol
SMILES	N1C(N(C2=C(C1=O)C(N=C(N2)c1cc(ccc1)C)(C(F)(F)F)C(F)(F)F)c1ccc(cc1)F)=O
SPLASH	splash10-014i-9851800000-2660784559accda0535c
Wiley ID	1443644