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96252-32-3

96252-32-3 structural image
Product Name: Deacetyl-O-demethyl Diltiazem Hydrochloride
Formula: C19H23ClN2O3S
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COMPUTED DESCRIPTORS

Molecular Weight 394.9 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 394.1117915 g/mol
Monoisotopic Mass 394.1117915 g/mol
Topological Polar Surface Area 89.3 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 454
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes