Home Sulfos 5-Chloro-N-(2,4-dimethoxybenzyl)-2,4-difluoro-N-(thiazol-2-yl)benzenesulfonamide

5-Chloro-N-(2,4-dimethoxybenzyl)-2,4-difluoro-N-(thiazol-2-yl)benzenesulfonamide

CAS No.:
1629041-92-4
Catalog Number:
AG01CCS4
Molecular Formula:
C18H15ClF2N2O4S2
Molecular Weight:
460.9025
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Product Description
Catalog Number:
AG01CCS4
Chemical Name:
5-Chloro-N-(2,4-dimethoxybenzyl)-2,4-difluoro-N-(thiazol-2-yl)benzenesulfonamide
CAS Number:
1629041-92-4
Molecular Formula:
C18H15ClF2N2O4S2
Molecular Weight:
460.9025
MDL Number:
MFCD31630931
IUPAC Name:
5-chloro-N-[(2,4-dimethoxyphenyl)methyl]-2,4-difluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide
InChI:
InChI=1S/C18H15ClF2N2O4S2/c1-26-12-4-3-11(16(7-12)27-2)10-23(18-22-5-6-28-18)29(24,25)17-8-13(19)14(20)9-15(17)21/h3-9H,10H2,1-2H3
InChI Key:
HJKGDCXPISYNCT-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)OC)CN(S(=O)(=O)c1cc(Cl)c(cc1F)F)c1nccs1
Properties
Complexity:
642  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
460.013g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
460.895g/mol
Monoisotopic Mass:
460.013g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Properties