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AIDS-125459

CAS No.:
7254-13-9
Catalog Number:
AG00FIEA
Molecular Formula:
C11H9N3O3S2
Molecular Weight:
295.3375
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$352
- +
5g
1 week
United States
$1270
- +
10g
1 week
United States
$1723
- +
25g
1 week
United States
$2566
- +
Product Description
Catalog Number:
AG00FIEA
Chemical Name:
AIDS-125459
CAS Number:
7254-13-9
Molecular Formula:
C11H9N3O3S2
Molecular Weight:
295.3375
MDL Number:
MFCD00022439
IUPAC Name:
N-[5-(4-nitrophenyl)sulfanyl-1,3-thiazol-2-yl]acetamide
InChI:
InChI=1S/C11H9N3O3S2/c1-7(15)13-11-12-6-10(19-11)18-9-4-2-8(3-5-9)14(16)17/h2-6H,1H3,(H,12,13,15)
InChI Key:
YKTLZNQOOIRKMH-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ncc(s1)Sc1ccc(cc1)[N+](=O)[O-]
NSC Number:
72988
Properties
Complexity:
343  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.009g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
295.331g/mol
Monoisotopic Mass:
295.009g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
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
Properties