Home Carboxys 2-Furancarboxylic acid,5-[(dimethylamino)methyl]-, hydrazide

2-Furancarboxylic acid,5-[(dimethylamino)methyl]-, hydrazide

CAS No.:
103852-00-2
Catalog Number:
AG0085A2
Molecular Formula:
C8H13N3O2
Molecular Weight:
183.2077
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Product Description
Catalog Number:
AG0085A2
Chemical Name:
2-Furancarboxylic acid,5-[(dimethylamino)methyl]-, hydrazide
CAS Number:
103852-00-2
Molecular Formula:
C8H13N3O2
Molecular Weight:
183.2077
MDL Number:
MFCD06358042
IUPAC Name:
5-[(dimethylamino)methyl]furan-2-carbohydrazide
InChI:
InChI=1S/C8H13N3O2/c1-11(2)5-6-3-4-7(13-6)8(12)10-9/h3-4H,5,9H2,1-2H3,(H,10,12)
InChI Key:
UPPGABHYVZPNEQ-UHFFFAOYSA-N
SMILES:
NNC(=O)c1ccc(o1)CN(C)C
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.101g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
183.211g/mol
Monoisotopic Mass:
183.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
71.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
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