N-(4-Fluorophenyl)-3-((3-(trifluoromethyl)benzyl)sulfanyl)-2-thiophenecarboxamide

Base Information

• Chemical Name: N-(4-Fluorophenyl)-3-((3-(trifluoromethyl)benzyl)sulfanyl)-2-thiophenecarboxamide
• CAS No.: 250714-43-3
• Molecular Formula: C19H13F4NOS2
• Molecular Weight: 411.4
• DSSTox Substance ID: DTXSID401127106
• ChEMBL ID: CHEMBL1581242
• Mol file: 250714-43-3.mol

Synonyms:250714-43-3;N-(4-Fluorophenyl)-3-((3-(trifluoromethyl)benzyl)sulfanyl)-2-thiophenecarboxamide;N-(4-fluorophenyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)thiophene-2-carboxamide;N-(4-fluorophenyl)-3-{[3-(trifluoromethyl)benzyl]sulfanyl}-2-thiophenecarboxamide;MLS000325569;CHEMBL1581242;REGID_for_CID_2765038;DTXSID401127106;HMS2446P21;AKOS005074448;N-(4-fluorophenyl)-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]thiophene-2-carboxamide;10G-339S;SMR000169984;N-(4-fluorophenyl)-3-(3-(trifluoromethyl)benzylthio)thiophene-2-carboxamide;N-(4-Fluorophenyl)-3-[[[3-(trifluoromethyl)phenyl]methyl]thio]-2-thiophenecarboxamide

Chemical Property of N-(4-Fluorophenyl)-3-((3-(trifluoromethyl)benzyl)sulfanyl)-2-thiophenecarboxamide

Chemical Property:

• PKA: 10.81±0.70(Predicted)
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 411.03746903
• Heavy Atom Count: 27
• Complexity: 497

Purity/Quality:

N-(4-FLUOROPHENYL)-3-((3-(TRIFLUOROMETHYL)BENZYL)SULFANYL)-2-THIOPHENECARBOXAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)C(F)(F)F)CSC2=C(SC=C2)C(=O)NC3=CC=C(C=C3)F