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129689-30-1

129689-30-1 structural image
Product Name: ZD 7114 hydrochloride
Formula: C22H30N2O6
Synonyms: Acetamide, 2-[4-[2-[[(2S)-2-hydroxy-3-phenoxypropyl]amino]ethoxy]phenoxy]-N-(2-methoxyethyl)-;ICI D7114
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COMPUTED DESCRIPTORS

Molecular Weight 418.5 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 15
Exact Mass 418.21038668 g/mol
Monoisotopic Mass 418.21038668 g/mol
Topological Polar Surface Area 98.3 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 439
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes