Formula |
C22H18F3N6O2+ |
IUPAC Name |
n-[3-(2-amino-8-methyl-7-oxopyrimido[4,5-d]pyrimidin-8-ium-6-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide |
Molecular Mass |
455.413 g·mol−1 |
Heat of Formation |
2477.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.79 ± 1.08 D |
Volume |
446.34 Å 3 |
Surface Area |
399.39 Å 2 |
Point Group Symmetry |
C1
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Synonyms
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- 7mp
- n-[3-(2-amino-7-keto-8-methyl-pyrimido[4,5-d]pyrimidin-8-ium-6-yl)-4-methyl-phenyl]-3-(trifluoromethyl)benzamide
- n-[3-(2-amino-8-methyl-7-oxo-6-pyrimido[4,5-d]pyrimidin-8-iumyl)-4-methylphenyl]-3-(trifluoromethyl)benzamide
- n-[3-(2-amino-8-methyl-7-oxo-pyrimido[4,5-d]pyrimidin-8-ium-6-yl)-4-methyl-phenyl]-3-(trifluoromethyl)benzamide
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InChIKey |
SQOIIWIQKKMCCG-UHFFFAOYSA-O |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
C
N
O
F
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