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Home Sulfos 1-(2,4,6-Triisopropylbenzenesulfonyl)imidazole

1-(2,4,6-Triisopropylbenzenesulfonyl)imidazole

CAS No.:
50257-40-4
Catalog Number:
AG003CSQ
Molecular Formula:
C18H26N2O2S
Molecular Weight:
334.4762
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$45
- +
10g
98%
In Stock USA
United States
$82
- +
25g
98%
In Stock USA
United States
$175
- +
100g
98%
In Stock USA
United States
$538
- +
Product Description
Catalog Number:
AG003CSQ
Chemical Name:
1-(2,4,6-Triisopropylbenzenesulfonyl)imidazole
CAS Number:
50257-40-4
Molecular Formula:
C18H26N2O2S
Molecular Weight:
334.4762
MDL Number:
MFCD00005283
IUPAC Name:
1-[2,4,6-tri(propan-2-yl)phenyl]sulfonylimidazole
InChI:
InChI=1S/C18H26N2O2S/c1-12(2)15-9-16(13(3)4)18(17(10-15)14(5)6)23(21,22)20-8-7-19-11-20/h7-14H,1-6H3
InChI Key:
AGGRGODMKWLSDE-UHFFFAOYSA-N
SMILES:
CC(c1cc(cc(c1S(=O)(=O)n1cncc1)C(C)C)C(C)C)C
EC Number:
256-509-5
Properties
Complexity:
464  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.171g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.478g/mol
Monoisotopic Mass:
334.171g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
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