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72100-51-7

72100-51-7 structural image
Product Name: 4-AMINO-5-BENZOYL-2-MORPHOLINO-3-THIOPHENECARBONITRILE
Formula: C16H15N3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 313.4 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 313.08849790 g/mol
Monoisotopic Mass 313.08849790 g/mol
Topological Polar Surface Area 108 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 452
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes