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Home > Sulfanilamide > 871114-03-3
871114-03-3 | [1,1'-Biphenyl]-4-sulfonamide, N-(4-hydroxybutyl)-3'-methyl-
CAS No: 871114-03-3 Catalog No: AG004P6Q MDL No:
Product Description
Catalog Number:
AG004P6Q
Chemical Name:
[1,1'-Biphenyl]-4-sulfonamide, N-(4-hydroxybutyl)-3'-methyl-
CAS Number:
871114-03-3
Molecular Formula:
C17H21NO3S
Molecular Weight:
319.4185
IUPAC Name:
N-(4-hydroxybutyl)-4-(3-methylphenyl)benzenesulfonamide
InChI:
InChI=1S/C17H21NO3S/c1-14-5-4-6-16(13-14)15-7-9-17(10-8-15)22(20,21)18-11-2-3-12-19/h4-10,13,18-19H,2-3,11-12H2,1H3
InChI Key:
HCXAIVAKNWWWHG-UHFFFAOYSA-N
SMILES:
OCCCCNS(=O)(=O)c1ccc(cc1)c1cccc(c1)C
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.124g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
319.419g/mol
Monoisotopic Mass:
319.124g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Development and characterization of biphenylsulfonamides as novel inhibitors of bone resorption. | Journal of medicinal chemistry 20061214 |
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