AC1MJFQK structure

AC1MJFQK

3-methylbutyl 6-(3-bromo-4-hydroxy-5-methoxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate

Also Known As: Oprea1_211375|Oprea1_715996|BAS 00553039|AG-690/37024070|SR-01000367469-1|3-methylbutyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|3-methylbutyl 6-(3-bromo-4-hydroxy-5-methoxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate|isopentyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate|3-methylbutyl 6-(3-bromo-4-hydroxy-5-methoxyphenyl)-3,4-dimethyl-2-oxo-1,3,6-t rihydropyrimidine-5-carboxylate|isopentyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

CAS: 418808-86-3
Molecular Formula C19H25BrN2O5
Molecular Weight 440.09467 g/mol
LogP 3.7227
Topological Polar Surface Area 88.1 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 440.09467
Monoisotopic Mass 440.09467
Heavy Atoms 27
Complexity 775.60864

Chemical Identifiers

CAS Number 418808-86-3
SMILES CC1=C(C(NC(=O)N1C)C2=CC(=C(C(=C2)Br)O)OC)C(=O)OCCC(C)C

Product Overview

AC1MJFQK (CAS 418808-86-3), with molecular formula C19H25BrN2O5 and molecular weight 440.09467 g/mol. IUPAC: 3-methylbutyl 6-(3-bromo-4-hydroxy-5-methoxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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