200,000+ products from a single source!
sales@angenechem.com
Home > Sulfanilamide > 866042-84-4
866042-84-4 | 4-tert-butyl-N-[2-(pyrazin-2-ylsulfanyl)phenyl]benzene-1-sulfonamide
CAS No: 866042-84-4 Catalog No: AG00IX64 MDL No:MFCD05670607
Product Description
Catalog Number:
AG00IX64
Chemical Name:
4-tert-butyl-N-[2-(pyrazin-2-ylsulfanyl)phenyl]benzene-1-sulfonamide
CAS Number:
866042-84-4
Molecular Formula:
C20H21N3O2S2
Molecular Weight:
399.5296
MDL Number:
MFCD05670607
IUPAC Name:
4-tert-butyl-N-(2-pyrazin-2-ylsulfanylphenyl)benzenesulfonamide
InChI:
InChI=1S/C20H21N3O2S2/c1-20(2,3)15-8-10-16(11-9-15)27(24,25)23-17-6-4-5-7-18(17)26-19-14-21-12-13-22-19/h4-14,23H,1-3H3
InChI Key:
XJASIVRIHLBDBJ-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)S(=O)(=O)Nc1ccccc1Sc1nccnc1)(C)C
Properties
Complexity:
563
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.108g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
399.527g/mol
Monoisotopic Mass:
399.108g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.