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Home > Sulfanilamide > 871113-91-6
871113-91-6 | [1,1'-Biphenyl]-4-sulfonamide, 4'-hydroxy-N-(5-hydroxypentyl)-
CAS No: 871113-91-6 Catalog No: AG004P6T MDL No:
Product Description
Catalog Number:
AG004P6T
Chemical Name:
[1,1'-Biphenyl]-4-sulfonamide, 4'-hydroxy-N-(5-hydroxypentyl)-
CAS Number:
871113-91-6
Molecular Formula:
C17H21NO4S
Molecular Weight:
335.4179
IUPAC Name:
N-(5-hydroxypentyl)-4-(4-hydroxyphenyl)benzenesulfonamide
InChI:
InChI=1S/C17H21NO4S/c19-13-3-1-2-12-18-23(21,22)17-10-6-15(7-11-17)14-4-8-16(20)9-5-14/h4-11,18-20H,1-3,12-13H2
InChI Key:
XLNXIKORJLDRAH-UHFFFAOYSA-N
SMILES:
OCCCCCNS(=O)(=O)c1ccc(cc1)c1ccc(cc1)O
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.119g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
335.418g/mol
Monoisotopic Mass:
335.119g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
95A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Development and characterization of biphenylsulfonamides as novel inhibitors of bone resorption. | Journal of medicinal chemistry 20061214 |
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