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844449-75-8

844449-75-8 structural image
Product Name: N-[(3,5-dimethoxyphenyl)methyl]-8-methyl-5H-pyrimido[5,4-b]indol-4-amine
Formula: C20H20N4O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 0.7 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 348.4 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 348.15862589 g/mol
Monoisotopic Mass 348.15862589 g/mol
Topological Polar Surface Area 72.1 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 453
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