Home Other Building Blocks Thiourea, N-[2-(trifluoromethoxy)phenyl]-

Thiourea, N-[2-(trifluoromethoxy)phenyl]-

CAS No.:
175205-24-0
Catalog Number:
AG0020OD
Molecular Formula:
C8H7F3N2OS
Molecular Weight:
236.2142
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG0020OD
Chemical Name:
Thiourea, N-[2-(trifluoromethoxy)phenyl]-
CAS Number:
175205-24-0
Molecular Formula:
C8H7F3N2OS
Molecular Weight:
236.2142
MDL Number:
MFCD00052991
IUPAC Name:
[2-(trifluoromethoxy)phenyl]thiourea
InChI:
InChI=1S/C8H7F3N2OS/c9-8(10,11)14-6-4-2-1-3-5(6)13-7(12)15/h1-4H,(H3,12,13,15)
InChI Key:
HYKOSRYWIURWQI-UHFFFAOYSA-N
SMILES:
NC(=S)Nc1ccccc1OC(F)(F)F
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.023g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
236.212g/mol
Monoisotopic Mass:
236.023g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties