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Home Aminos N-{[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl}acetamide

N-{[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl}acetamide

CAS No.:
150208-26-7
Catalog Number:
AG019OVM
Molecular Formula:
C10H11N3O2S
Molecular Weight:
237.2782
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Product Description
Catalog Number:
AG019OVM
Chemical Name:
N-{[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl}acetamide
CAS Number:
150208-26-7
Molecular Formula:
C10H11N3O2S
Molecular Weight:
237.2782
MDL Number:
MFCD07838302
IUPAC Name:
N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide
InChI:
InChI=1S/C10H11N3O2S/c1-6(14)12-4-7-2-3-9(15-7)8-5-16-10(11)13-8/h2-3,5H,4H2,1H3,(H2,11,13)(H,12,14)
InChI Key:
HMOORGLQDZENJJ-UHFFFAOYSA-N
SMILES:
CC(=O)NCc1ccc(o1)c1csc(n1)N
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.057g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
237.277g/mol
Monoisotopic Mass:
237.057g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
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