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845665-97-6

845665-97-6 structural image
Product Name: N-[(2-chlorophenyl)methyl]-5H-pyrimido[5,4-b]indol-4-amine
Formula: C17H13ClN4
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COMPUTED DESCRIPTORS

Molecular Weight 308.8 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 308.0828741 g/mol
Monoisotopic Mass 308.0828741 g/mol
Topological Polar Surface Area 53.6 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 380
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