AC1LP6E9 structure

AC1LP6E9

2-[[6-(1,3-benzodioxol-5-yl)-3-cyano-4-(trifluoromethyl)-2-pyridinyl]sulfanyl]-N-(4-methyl-1,3-oxazol-2-yl)acetamide

Also Known As: KS-00003RV9|SS-0405|2-{[6-(2H-1,3-benzodioxol-5-yl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-(4-methyl-1,3-oxazol-2-yl)acetamide|SR-03000003634-1|2-[6-(1,3-benzodioxol-5-yl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(4-methyl-1,3-oxazol-2-yl)acetamide|2-{[6-(1,3-benzodioxol-5-yl)-3-cyano-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}-N-(4-methyl-1,3-oxazol-2-yl)acetamide|2-((6-(benzo[d][1,3]dioxol-5-yl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl)thio)-N-(4-methyloxazol-2-yl)acetamide|2-{[6-(1,3-benzodioxol-5-yl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-(4-methyl-1,3-oxazol-2-yl)acetamide

CAS: 625378-08-7
Molecular Formula C20H13F3N4O4S
Molecular Weight 462.06097 g/mol
LogP 4.395
Topological Polar Surface Area 110.27 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 8
Rotatable Bonds 5
Exact Mass 462.06097
Monoisotopic Mass 462.06097
Heavy Atoms 32
Complexity 1236.5585

Chemical Identifiers

CAS Number 625378-08-7
SMILES CC1=COC(=N1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC4=C(C=C3)OCO4)C(F)(F)F)C#N

Product Overview

AC1LP6E9 (CAS 625378-08-7), with molecular formula C20H13F3N4O4S and molecular weight 462.06097 g/mol. IUPAC: 2-[[6-(1,3-benzodioxol-5-yl)-3-cyano-4-(trifluoromethyl)-2-pyridinyl]sulfanyl]-N-(4-methyl-1,3-oxazol-2-yl)acetamide.

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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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