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Home > Sulfanilamide > 1018240-62-4
1018240-62-4 | Benzenesulfonamide, 3-cyano-N-[(4-methoxyphenyl)methyl]-
CAS No: 1018240-62-4 Catalog No: AG0005NH MDL No:
Product Description
Catalog Number:
AG0005NH
Chemical Name:
Benzenesulfonamide, 3-cyano-N-[(4-methoxyphenyl)methyl]-
CAS Number:
1018240-62-4
Molecular Formula:
C15H14N2O3S
Molecular Weight:
302.3483
IUPAC Name:
3-cyano-N-[(4-methoxyphenyl)methyl]benzenesulfonamide
InChI:
InChI=1S/C15H14N2O3S/c1-20-14-7-5-12(6-8-14)11-17-21(18,19)15-4-2-3-13(9-15)10-16/h2-9,17H,11H2,1H3
InChI Key:
GQNXTNDXBDJMAA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CNS(=O)(=O)c1cccc(c1)C#N
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.073g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
302.348g/mol
Monoisotopic Mass:
302.073g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
87.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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