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318256-27-8

318256-27-8 structural image
Product Name: N-(TERT-BUTYL)-2-(3-NITRO-2-PYRIDINYL)-1,2,3,4-TETRAHYDRO-3-ISOQUINOLINECARBOXAMIDE
Formula: C19H22N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 354.4 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 354.16919058 g/mol
Monoisotopic Mass 354.16919058 g/mol
Topological Polar Surface Area 91 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 528
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes