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Home > Nitro Compounds > 64398-84-1
64398-84-1 | N-(5-nitro-2-thiazolyl)benzamide
CAS No: 64398-84-1 Catalog No: AG00F761 MDL No:MFCD00085575
Product Description
Catalog Number:
AG00F761
Chemical Name:
N-(5-nitro-2-thiazolyl)benzamide
CAS Number:
64398-84-1
Molecular Formula:
C10H7N3O3S
Molecular Weight:
249.2459
MDL Number:
MFCD00085575
IUPAC Name:
N-(5-nitro-1,3-thiazol-2-yl)benzamide
InChI:
InChI=1S/C10H7N3O3S/c14-9(7-4-2-1-3-5-7)12-10-11-6-8(17-10)13(15)16/h1-6H,(H,11,12,14)
InChI Key:
TYUHMMUUMWZPDB-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Nc1ncc(s1)[N+](=O)[O-]
EC Number:
264-868-4
NSC Number:
87574
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.021g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.244g/mol
Monoisotopic Mass:
249.021g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Biological activity of modified and exchanged 2-amino-5-nitrothiazole amide analogues of nitazoxanide. | Bioorganic & medicinal chemistry letters 20100615 |
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