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86408-27-7 | Benzenesulfonamide, 4-dodecyl-N-8-quinolinyl-
CAS No: 86408-27-7 Catalog No: AG008GD4 MDL No:
Product Description
Catalog Number:
AG008GD4
Chemical Name:
Benzenesulfonamide, 4-dodecyl-N-8-quinolinyl-
CAS Number:
86408-27-7
Molecular Formula:
C27H36N2O2S
Molecular Weight:
452.6519
IUPAC Name:
4-dodecyl-N-quinolin-8-ylbenzenesulfonamide
InChI:
InChI=1S/C27H36N2O2S/c1-2-3-4-5-6-7-8-9-10-11-14-23-18-20-25(21-19-23)32(30,31)29-26-17-12-15-24-16-13-22-28-27(24)26/h12-13,15-22,29H,2-11,14H2,1H3
InChI Key:
YQILURFFNKWIJC-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1cccc2c1nccc2
Properties
Complexity:
595
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
452.25g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
452.657g/mol
Monoisotopic Mass:
452.25g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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