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339015-89-3

339015-89-3 structural image
Product Name: ETHYL 1,2-DIAMINO-5-CYANO-4-[4-(DIMETHYLAMINO)PHENYL]-6-OXO-1,6-DIHYDRO-3-PYRIDINECARBOXYLATE
Formula: C17H19N5O3
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COMPUTED DESCRIPTORS

Molecular Weight 341.4 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 341.14878949 g/mol
Monoisotopic Mass 341.14878949 g/mol
Topological Polar Surface Area 126 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 678
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