[2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
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![[2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3ae1c6757e444d7ba2c82d4423a20317.png "[2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate")
[2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
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CAS No:
729585-31-3
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Formula:
C16H13BrFN5O3
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Chemical Name:
[2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
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Synonyms:
ZINC3291813;AKOS033691884;MCULE-2395847239;AB00717201-01;SR-01000040849;SR-01000040849-1;Z19573590;[(4-bromo-2-fluorophenyl)carbamoyl]methyl 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate;729585-31-3
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CAS No:
[2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate Basic Attributes
422.21 g/mol
421.01858 g/mol
Computed Properties
Molecular Weight:422.21
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:421.01858
Monoisotopic Mass:421.01858
Topological Polar Surface Area:98.5
Heavy Atom Count:26
Complexity:542
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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