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846579-74-6

846579-74-6 structural image
Product Name: 5-(furan-2-yl)-N-(3-methoxypropyl)-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Formula: C22H24N4O3S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 1.3 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 424.5 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 6
Exact Mass 424.15691181 g/mol
Monoisotopic Mass 424.15691181 g/mol
Topological Polar Surface Area 111 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 597
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