Home Halogens Benzamide, 5-chloro-2-hydroxy-N-[3-(trifluoromethyl)phenyl]-

Benzamide, 5-chloro-2-hydroxy-N-[3-(trifluoromethyl)phenyl]-

CAS No.:
1580-42-3
Catalog Number:
AG001PWA
Molecular Formula:
C14H9ClF3NO2
Molecular Weight:
315.6750
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Product Description
Catalog Number:
AG001PWA
Chemical Name:
Benzamide, 5-chloro-2-hydroxy-N-[3-(trifluoromethyl)phenyl]-
CAS Number:
1580-42-3
Molecular Formula:
C14H9ClF3NO2
Molecular Weight:
315.6750
MDL Number:
MFCD01538275
IUPAC Name:
5-chloro-2-hydroxy-N-[3-(trifluoromethyl)phenyl]benzamide
InChI:
InChI=1S/C14H9ClF3NO2/c15-9-4-5-12(20)11(7-9)13(21)19-10-3-1-2-8(6-10)14(16,17)18/h1-7,20H,(H,19,21)
InChI Key:
OAMVIBKEICGPKK-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)C(=O)Nc1cccc(c1)C(F)(F)F)O
Properties
Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.027g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
315.676g/mol
Monoisotopic Mass:
315.027g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Literature
Title Journal
Structure-activity relationships of antitubercular salicylanilides consistent with disruption of the proton gradient via proton shuttling. Bioorganic & medicinal chemistry 20130101
Salicylanilide inhibitors of Toxoplasma gondii. Journal of medicinal chemistry 20121011
Properties