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175653-42-6

175653-42-6 | Benzamide, 2-nitro-N-2-thiazolyl-

CAS No: 175653-42-6 Catalog No: AG00HZOF MDL No:MFCD00508593

Product Description

Catalog Number:
AG00HZOF
Chemical Name:
Benzamide, 2-nitro-N-2-thiazolyl-
CAS Number:
175653-42-6
Molecular Formula:
C10H7N3O3S
Molecular Weight:
249.2459
MDL Number:
MFCD00508593
IUPAC Name:
2-nitro-N-(1,3-thiazol-2-yl)benzamide
InChI:
InChI=1S/C10H7N3O3S/c14-9(12-10-11-5-6-17-10)7-3-1-2-4-8(7)13(15)16/h1-6H,(H,11,12,14)
InChI Key:
WJDNQCITOMEIGG-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1[N+](=O)[O-])Nc1nccs1

Properties

Complexity:
308  
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:
2  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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