4-(3-chloro-4-fluoroanilino)-6-(pyridin-3-ylmethylamino)-1,7-naphthyridine-3-carbonitrile


Chemical Name: 4-(3-chloro-4-fluoroanilino)-6-(pyridin-3-ylmethylamino)-1,7-naphthyridine-3-carbonitrile
CAS Number: 871307-18-5
Product Number: AG004OTF(AGN-PC-0MTEI2)
Synonyms:
MDL No:
Molecular Formula: C21H14ClFN6
Molecular Weight: 404.8275

Identification/Properties


Properties
BP:
616.318 °C at 760 mmHg
Storage:
-10 ℃;
Computed Properties
Molecular Weight:
404.833g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
5
Exact Mass:
404.095g/mol
Monoisotopic Mass:
404.095g/mol
Topological Polar Surface Area:
86.5A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
585
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

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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