sales@angenesci.com
Login | Register
logo
Structures Search
Home Sulfos 4-{[(2,2,2-trifluoroethyl)amino]methyl}benzene-1-sulfonamide

4-{[(2,2,2-trifluoroethyl)amino]methyl}benzene-1-sulfonamide

CAS No.:
848178-44-9
Catalog Number:
AG00IDG6
Molecular Formula:
C9H11F3N2O2S
Molecular Weight:
268.2560
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00IDG6
Chemical Name:
4-{[(2,2,2-trifluoroethyl)amino]methyl}benzene-1-sulfonamide
CAS Number:
848178-44-9
Molecular Formula:
C9H11F3N2O2S
Molecular Weight:
268.2560
MDL Number:
MFCD07323618
IUPAC Name:
4-[(2,2,2-trifluoroethylamino)methyl]benzenesulfonamide
InChI:
InChI=1S/C9H11F3N2O2S/c10-9(11,12)6-14-5-7-1-3-8(4-2-7)17(13,15)16/h1-4,14H,5-6H2,(H2,13,15,16)
InChI Key:
HDSKWXVELRSKAX-UHFFFAOYSA-N
SMILES:
FC(CNCc1ccc(cc1)S(=O)(=O)N)(F)F
Properties
Complexity:
329  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.049g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
268.254g/mol
Monoisotopic Mass:
268.049g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
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