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332097-09-3 | Benzenesulfonamide, 4-[(2-ethylhexyl)oxy]-N-(4-phenyl-2-thiazolyl)-
CAS No: 332097-09-3 Catalog No: AG007GR4 MDL No:
Product Description
Catalog Number:
AG007GR4
Chemical Name:
Benzenesulfonamide, 4-[(2-ethylhexyl)oxy]-N-(4-phenyl-2-thiazolyl)-
CAS Number:
332097-09-3
Molecular Formula:
C23H28N2O3S2
Molecular Weight:
444.6100
IUPAC Name:
4-(2-ethylhexoxy)-N-(4-phenyl-1,3-thiazol-2-yl)benzenesulfonamide
InChI:
InChI=1S/C23H28N2O3S2/c1-3-5-9-18(4-2)16-28-20-12-14-21(15-13-20)30(26,27)25-23-24-22(17-29-23)19-10-7-6-8-11-19/h6-8,10-15,17-18H,3-5,9,16H2,1-2H3,(H,24,25)
InChI Key:
HVLAPVSPKNTFAU-UHFFFAOYSA-N
SMILES:
CCCCC(COc1ccc(cc1)S(=O)(=O)Nc1scc(n1)c1ccccc1)CC
Properties
Complexity:
582
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
444.154g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
444.608g/mol
Monoisotopic Mass:
444.154g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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