3-({[(5-Bromo-2-methoxyphenyl)carbonyl]carbamothioyl}amino)-4-chlorobenzoic acid structure

3-({[(5-Bromo-2-methoxyphenyl)carbonyl]carbamothioyl}amino)-4-chlorobenzoic acid

3-[(5-bromo-2-methoxybenzoyl)carbamothioylamino]-4-chlorobenzoic acid

Also Known As: 3-[[[ AMINO]THIOXOMETHYL]AMINO]-4-CHLORO-BENZOICACID|3-[[[(5-BROMO-2-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-4-CHLORO-BENZOIC ACID|3-[3-(5-bromo-2-methoxy-benzoyl)-thioureido]-4-chloro-benzoic acid|3-[(5-bromo-2-methoxy-benzoyl)thiocarbamoylamino]-4-chloro-benzoic Acid|3-[(5-bromo-2-methoxybenzoyl)carbamothioylamino]-4-chlorobenzoic acid|3-({[(5-bromo-2-methoxybenzoyl)amino]carbonothioyl}amino)-4-chlorobenzoic acid|3-({[(5-bromo-2-methoxyphenyl)carbonyl]carbamothioyl}amino)-4-chlorobenzoic acid|3-[[[(5-Bromo-2-methoxybenzoyl)amino]thioxomethyl ]amino]-4-chloro-benzoic acid

CAS: 530147-59-2
Molecular Formula C16H12BrClN2O4S
Molecular Weight 441.93896 g/mol
LogP 3.9361
Topological Polar Surface Area 87.66 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 441.93896
Monoisotopic Mass 441.93896
Heavy Atoms 25
Complexity 860.0235

Chemical Identifiers

CAS Number 530147-59-2
SMILES COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=C(C=CC(=C2)C(=O)O)Cl

Product Overview

3-({[(5-Bromo-2-methoxyphenyl)carbonyl]carbamothioyl}amino)-4-chlorobenzoic acid (CAS 530147-59-2), with molecular formula C16H12BrClN2O4S and molecular weight 441.93896 g/mol. IUPAC: 3-[(5-bromo-2-methoxybenzoyl)carbamothioylamino]-4-chlorobenzoic acid.

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3-({[(5-Bromo-2-methoxyphenyl)carbonyl]carbamothioyl}amino)-4-chlorobenzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.

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