6-amino-4-(3-chloro-4-fluoroanilino)-7-ethoxyquinoline-3-carbonitrile


Chemical Name: 6-amino-4-(3-chloro-4-fluoroanilino)-7-ethoxyquinoline-3-carbonitrile
CAS Number: 361162-95-0
Product Number: AG01CBMF(AGN-PC-0NET98)
Synonyms:
MDL No:
Molecular Formula: C18H14ClFN4O
Molecular Weight: 356.7814

Identification/Properties


Computed Properties
Molecular Weight:
356.785g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Exact Mass:
356.084g/mol
Monoisotopic Mass:
356.084g/mol
Topological Polar Surface Area:
84A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
501
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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