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Home > Sulfanilamide > 864685-52-9
864685-52-9 | Benzenesulfonamide,N-[(4-cyanophenyl)methyl]-2-methoxy-
CAS No: 864685-52-9 Catalog No: AG004MQK MDL No:
Product Description
Catalog Number:
AG004MQK
Chemical Name:
Benzenesulfonamide,N-[(4-cyanophenyl)methyl]-2-methoxy-
CAS Number:
864685-52-9
Molecular Formula:
C15H14N2O3S
Molecular Weight:
302.3483
IUPAC Name:
N-[(4-cyanophenyl)methyl]-2-methoxybenzenesulfonamide
InChI:
InChI=1S/C15H14N2O3S/c1-20-14-4-2-3-5-15(14)21(18,19)17-11-13-8-6-12(10-16)7-9-13/h2-9,17H,11H2,1H3
InChI Key:
WCLLGJTVYVTBQE-UHFFFAOYSA-N
SMILES:
COc1ccccc1S(=O)(=O)NCc1ccc(cc1)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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