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Home > Imidazoles > 827579-44-2
827579-44-2 | Benzenesulfonyl chloride, 4-(2-oxo-1-imidazolidinyl)-
CAS No: 827579-44-2 Catalog No: AG005771 MDL No:
Product Description
Catalog Number:
AG005771
Chemical Name:
Benzenesulfonyl chloride, 4-(2-oxo-1-imidazolidinyl)-
CAS Number:
827579-44-2
Molecular Formula:
C9H9ClN2O3S
Molecular Weight:
260.6974
IUPAC Name:
4-(2-oxoimidazolidin-1-yl)benzenesulfonyl chloride
InChI:
InChI=1S/C9H9ClN2O3S/c10-16(14,15)8-3-1-7(2-4-8)12-6-5-11-9(12)13/h1-4H,5-6H2,(H,11,13)
InChI Key:
RMEQLFLQQGVWBY-UHFFFAOYSA-N
SMILES:
O=C1NCCN1c1ccc(cc1)S(=O)(=O)Cl
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.002g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.692g/mol
Monoisotopic Mass:
260.002g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
| Title | Journal |
|---|---|
| Design, synthesis, biological evaluation, and structure-activity relationships of substituted phenyl 4-(2-oxoimidazolidin-1-yl)benzenesulfonates as new tubulin inhibitors mimicking combretastatin A-4. | Journal of medicinal chemistry 20110714 |
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