Home Aminos 1H-Imidazole-4-carboxamide, 5-amino-1,2-dimethyl-

1H-Imidazole-4-carboxamide, 5-amino-1,2-dimethyl-

CAS No.:
78750-93-3
Catalog Number:
AG008M2A
Molecular Formula:
C6H10N4O
Molecular Weight:
154.1698
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Product Description
Catalog Number:
AG008M2A
Chemical Name:
1H-Imidazole-4-carboxamide, 5-amino-1,2-dimethyl-
CAS Number:
78750-93-3
Molecular Formula:
C6H10N4O
Molecular Weight:
154.1698
MDL Number:
MFCD02752921
IUPAC Name:
5-amino-1,2-dimethylimidazole-4-carboxamide
InChI:
InChI=1S/C6H10N4O/c1-3-9-4(6(8)11)5(7)10(3)2/h7H2,1-2H3,(H2,8,11)
InChI Key:
HMZZWLKDLHIYQO-UHFFFAOYSA-N
SMILES:
NC(=O)c1nc(n(c1N)C)C
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.085g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
154.173g/mol
Monoisotopic Mass:
154.085g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties