AC1M1IXO structure

AC1M1IXO

[2-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxoethyl] 3,4,5,6-tetrachloropyridine-2-carboxylate

Also Known As: ({3-carbamoyl-4H,5H,6H-cyclopenta[b]thiophen-2-yl}carbamoyl)methyl 3,4,5,6-tetrachloropyridine-2-carboxylate|[2-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxoethyl] 3,4,5,6-tetrachloropyridine-2-carboxylate

CAS: 744261-08-3
Molecular Formula C16H11Cl4N3O4S
Molecular Weight 480.92242 g/mol
LogP 4.1398
Topological Polar Surface Area 111.38 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 5
Exact Mass 480.92242
Monoisotopic Mass 482.9195
Heavy Atoms 28
Complexity 1008.50604

Chemical Identifiers

CAS Number 744261-08-3
SMILES C1CC2=C(C1)SC(=C2C(=O)N)NC(=O)COC(=O)C3=NC(=C(C(=C3Cl)Cl)Cl)Cl

Product Overview

AC1M1IXO (CAS 744261-08-3), with molecular formula C16H11Cl4N3O4S and molecular weight 480.92242 g/mol. IUPAC: [2-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxoethyl] 3,4,5,6-tetrachloropyridine-2-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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