Home Aminos 2-Methyl-3-amino-5-nitrobenzamide

2-Methyl-3-amino-5-nitrobenzamide

CAS No.:
3572-44-9
Catalog Number:
AG00CZRH
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00CZRH
Chemical Name:
2-Methyl-3-amino-5-nitrobenzamide
CAS Number:
3572-44-9
MDL Number:
MFCD01679715
IUPAC Name:
3-amino-2-methyl-5-nitrobenzamide
InChI:
InChI=1S/C8H9N3O3/c1-4-6(8(10)12)2-5(11(13)14)3-7(4)9/h2-3H,9H2,1H3,(H2,10,12)
InChI Key:
RBLRQBGOUCRKRT-UHFFFAOYSA-N
UNII:
KA9YLT68HA
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.064g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
195.178g/mol
Monoisotopic Mass:
195.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Literature
Title Journal
Quantitative structure-activity relationship and complex network approach to monoamine oxidase A and B inhibitors. Journal of medicinal chemistry 20081113
Properties