AC1NQ4OZ structure

AC1NQ4OZ

ethyl 2-[[2-(4-bromophenoxy)acetyl]amino]-4-(2-chlorophenyl)thiophene-3-carboxylate

Also Known As: AK-968/41022889|ethyl 2-{[(4-bromophenoxy)acetyl]amino}-4-(2-chlorophenyl)-3-thiophenecarboxylate|ethyl 2-[[2-(4-bromophenoxy)acetyl]amino]-4-(2-chlorophenyl)thiophene-3-carboxylate|ethyl 2-[2-(4-bromophenoxy)acetylamino]-4-(2-chlorophenyl)thiophene-3-carboxyl ate|ethyl 2-{[(4-bromophenoxy)acetyl]amino}-4-(2-chlorophenyl)thiophene-3-carboxylate

CAS: 445231-81-2
Molecular Formula C21H17BrClNO4S
Molecular Weight 492.975 g/mol
LogP 6.0252
Topological Polar Surface Area 64.63 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 492.975
Monoisotopic Mass 492.975
Heavy Atoms 29
Complexity 1019.7755

Chemical Identifiers

CAS Number 445231-81-2
SMILES CCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)COC3=CC=C(C=C3)Br

Product Overview

AC1NQ4OZ (CAS 445231-81-2), with molecular formula C21H17BrClNO4S and molecular weight 492.975 g/mol. IUPAC: ethyl 2-[[2-(4-bromophenoxy)acetyl]amino]-4-(2-chlorophenyl)thiophene-3-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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