[4-(4-bromophenyl)-4-oxobutyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
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![[4-(4-bromophenyl)-4-oxobutyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9ee8516691dc4dcf8fda3ead063cde9b.png "[4-(4-bromophenyl)-4-oxobutyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate")
[4-(4-bromophenyl)-4-oxobutyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
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CAS No:
734541-95-8
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Formula:
C18H17BrN4O3
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Chemical Name:
[4-(4-bromophenyl)-4-oxobutyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
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Synonyms:
ZINC3291838;AKOS033691868;MCULE-4759411348;SR-01000043694;SR-01000043694-1;Z19573529;4-(4-bromophenyl)-4-oxobutyl 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate;734541-95-8
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CAS No:
[4-(4-bromophenyl)-4-oxobutyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate Basic Attributes
417.3 g/mol
416.04840 g/mol
Computed Properties
Molecular Weight:417.3
XLogP3:3.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:416.04840
Monoisotopic Mass:416.04840
Topological Polar Surface Area:86.4
Heavy Atom Count:26
Complexity:513
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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