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117620-35-6 | 3-(Benzenesulfonyl)quinoline
CAS No: 117620-35-6 Catalog No: AG01FF8V MDL No:
Product Description
Catalog Number:
AG01FF8V
Chemical Name:
3-(Benzenesulfonyl)quinoline
CAS Number:
117620-35-6
Molecular Formula:
C15H11NO2S
Molecular Weight:
269.3183
IUPAC Name:
3-(benzenesulfonyl)quinoline
InChI:
InChI=1S/C15H11NO2S/c17-19(18,13-7-2-1-3-8-13)14-10-12-6-4-5-9-15(12)16-11-14/h1-11H
InChI Key:
AXBCWJNBYCCPGP-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)c1cnc2c(c1)cccc2
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.051g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.318g/mol
Monoisotopic Mass:
269.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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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