AC1MKBWX

2-[[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)-2-pyridinyl]sulfanyl]-2-phenylacetic acid

Also Known As: BAS 06899988|AM-807/13613021|(3-Cyano-6-thiophen-2-yl-4-trifluoromethyl-pyridin-2-ylsulfanyl)-phenyl-acetic acid|2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-phenylacetic acid|2-{[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-phenylacetic acid|{[3-cyano-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}(phenyl)acetic acid|2-((3-cyano-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridin-2-yl)thio)-2-phenylacetic acid|2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]thio]-2-phenyl-acetic acid|2-[[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)-2-pyridinyl]thio]-2-phenylacetic acid|2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-phenyl-ethanoic acid|racemic 2-((3-cyano-6-(thiophen-2-yl)-4-(trifluoromethyl)-pyridin-2-yl)thio)-2-phenylacetic acid

Molecular Formula	C19H11F3N2O2S2
Molecular Weight	420.0214 g/mol
LogP	5.61858
Topological Polar Surface Area	73.98 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	420.0214
Monoisotopic Mass	420.0214
Heavy Atoms	28
Complexity	1029.8225

Chemical Identifiers

CAS Number	354555-65-0
SMILES	C1=CC=C(C=C1)C(C(=O)O)SC2=C(C(=CC(=N2)C3=CC=CS3)C(F)(F)F)C#N