2-Propenamide,N-[(5-bromo-2-methoxyphenyl)sulfonyl]-3-[2-(2-naphthalenylmethyl)phenyl]-, (2E)-


Chemical Name: 2-Propenamide,N-[(5-bromo-2-methoxyphenyl)sulfonyl]-3-[2-(2-naphthalenylmethyl)phenyl]-, (2E)-
CAS Number: 244101-02-8
Product Number: AG006V9U(AGN-PC-0R07H7)
Synonyms:
MDL No:
Molecular Formula: C27H22BrNO4S
Molecular Weight: 536.4369

Identification/Properties


Computed Properties
Molecular Weight:
536.44g/mol
XLogP3:
6.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
7
Exact Mass:
535.045g/mol
Monoisotopic Mass:
535.045g/mol
Topological Polar Surface Area:
80.8A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
810
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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