methyl 5-amino-2-(4-methylpiperazin-1-yl)benzoate


Chemical Name: methyl 5-amino-2-(4-methylpiperazin-1-yl)benzoate
CAS Number: 774126-94-2
Product Number: AG00GI8V(AGN-PC-05RPKG)
Synonyms:
MDL No:
Molecular Formula: C13H19N3O2
Molecular Weight: 249.3089

Identification/Properties


Computed Properties
Molecular Weight:
249.314g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
249.148g/mol
Monoisotopic Mass:
249.148g/mol
Topological Polar Surface Area:
58.8A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
290
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

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NMR Spectrum


Other Analytical Data


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