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1214808-67-9

1214808-67-9 structural image
Product Name: 3-(4-CYANOPHENYL)-2-([(4-METHOXYPHENYL)SULFONYL]AMINO)PROPANOIC ACID
Formula: C17H16N2O5S
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COMPUTED DESCRIPTORS

Molecular Weight 360.4 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 7
Exact Mass 360.07799279 g/mol
Monoisotopic Mass 360.07799279 g/mol
Topological Polar Surface Area 125 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 590
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes