N-[(2-benzothiazol-2-yl-4-bromo-phenyl)thiocarbamoyl]-3-butoxy-benzamide structure

N-[(2-benzothiazol-2-yl-4-bromo-phenyl)thiocarbamoyl]-3-butoxy-benzamide

N-[[2-(1,3-benzothiazol-2-yl)-4-bromophenyl]carbamothioyl]-3-butoxybenzamide

Also Known As: N-[(2-benzothiazol-2-yl-4-bromo-phenyl)thiocarbamoyl]-3-butoxy-benzamide|N-[[2-(1,3-benzothiazol-2-yl)-4-bromophenyl]carbamothioyl]-3-butoxybenzamide|N-{[2-(1,3-Benzothiazol-2-yl)-4-bromophenyl]carbamothioyl}-3-butoxybenzamide

CAS: 5311-89-7
Molecular Formula C25H22BrN3O2S2
Molecular Weight 539.0337 g/mol
LogP 7.0315
Topological Polar Surface Area 63.25 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 539.0337
Monoisotopic Mass 539.0337
Heavy Atoms 33
Complexity 1272.8115

Chemical Identifiers

CAS Number 5311-89-7
SMILES CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4S3

Product Overview

N-[(2-benzothiazol-2-yl-4-bromo-phenyl)thiocarbamoyl]-3-butoxy-benzamide (CAS 5311-89-7), with molecular formula C25H22BrN3O2S2 and molecular weight 539.0337 g/mol. IUPAC: N-[[2-(1,3-benzothiazol-2-yl)-4-bromophenyl]carbamothioyl]-3-butoxybenzamide.

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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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N-[(2-benzothiazol-2-yl-4-bromo-phenyl)thiocarbamoyl]-3-butoxy-benzamide is a custom synthesis product. We offer services from milligram to kilogram scale.

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