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478247-95-9

478247-95-9 structural image
Product Name: 3-[(4-METHYLBENZYL)OXY]PYRIDO[1,2-A]INDOLE-10-CARBONITRILE
Formula: C21H16N2O
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COMPUTED DESCRIPTORS

Molecular Weight 312.4 g/mol
XLogP3 5.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 312.126263138 g/mol
Monoisotopic Mass 312.126263138 g/mol
Topological Polar Surface Area 37.4 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 476
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