AC1MGCON structure

AC1MGCON

methyl 3-[3-[3-[(2-methoxycarbonylthiophen-3-yl)amino]-3-oxopropyl]sulfanylpropanoylamino]thiophene-2-carboxylate

Also Known As: AK-968/13411725|methyl 3-[3-[3-[(2-methoxycarbonylthiophen-3-yl)amino]-3-oxopropyl]sulfanylpropanoylamino]thiophene-2-carboxylate|methyl 3-({3-[(3-{[2-(methoxycarbonyl)-3-thienyl]amino}-3-oxopropyl)sulfanyl]propanoyl}amino)-2-thiophenecarboxylate|dimethyl 3,3'-{sulfanediylbis[(1-oxopropane-3,1-diyl)imino]}dithiophene-2-carboxylate|methyl 3-[3-(2-{N-[2-(methoxycarbonyl)-3-thienyl]carbamoyl}ethylthio)propanoyl amino]thiophene-2-carboxylate

CAS: 548441-02-7
Molecular Formula C18H20N2O6S3
Molecular Weight 456.04834 g/mol
LogP 3.4734
Topological Polar Surface Area 110.8 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 9
Rotatable Bonds 10
Exact Mass 456.04834
Monoisotopic Mass 456.04834
Heavy Atoms 29
Complexity 806.33325

Chemical Identifiers

CAS Number 548441-02-7
SMILES COC(=O)C1=C(C=CS1)NC(=O)CCSCCC(=O)NC2=C(SC=C2)C(=O)OC

Product Overview

AC1MGCON (CAS 548441-02-7), with molecular formula C18H20N2O6S3 and molecular weight 456.04834 g/mol. IUPAC: methyl 3-[3-[3-[(2-methoxycarbonylthiophen-3-yl)amino]-3-oxopropyl]sulfanylpropanoylamino]thiophene-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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