methyl 3-amino-2-[[4-(2-cyanophenyl)phenyl]methylamino]benzoate


Chemical Name: methyl 3-amino-2-[[4-(2-cyanophenyl)phenyl]methylamino]benzoate
CAS Number: 136304-78-4
Product Number: AG009HX5(AGN-PC-0NKJVD)
Synonyms:
MDL No:
Molecular Formula: C22H19N3O2
Molecular Weight: 357.40516

Identification/Properties


Computed Properties
Molecular Weight:
357.413g/mol
XLogP3:
4.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
357.148g/mol
Monoisotopic Mass:
357.148g/mol
Topological Polar Surface Area:
88.1A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
535
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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