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298215-49-3

298215-49-3 structural image
Product Name: 4-[3-(4-METHYLPIPERAZINO)-3-OXO-1-PROPENYL]BENZENECARBONITRILE
Formula: C15H17N3O
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >38.3 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 255.31 g/mol
XLogP3 1.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 255.137162174 g/mol
Monoisotopic Mass 255.137162174 g/mol
Topological Polar Surface Area 47.3 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 379
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes