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883291-42-7

883291-42-7 structural image
Product Name: 3,5-PYRIDINEDICARBOXYLIC ACID, 4-(3-AMINOPHENYL)-2,6-DIMETHYL-, DIMETHYL ESTER
Formula: C17H18N2O4
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COMPUTED DESCRIPTORS

Molecular Weight 314.34 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 314.12665706 g/mol
Monoisotopic Mass 314.12665706 g/mol
Topological Polar Surface Area 91.5 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 414
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