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Home > Fluorides > 871114-02-2
871114-02-2 | [1,1'-Biphenyl]-4-sulfonamide, N-(4-hydroxybutyl)-4'-(trifluoromethoxy)-
CAS No: 871114-02-2 Catalog No: AG004P6R MDL No:
Product Description
Catalog Number:
AG004P6R
Chemical Name:
[1,1'-Biphenyl]-4-sulfonamide, N-(4-hydroxybutyl)-4'-(trifluoromethoxy)-
CAS Number:
871114-02-2
Molecular Formula:
C17H18F3NO4S
Molecular Weight:
389.3893
IUPAC Name:
N-(4-hydroxybutyl)-4-[4-(trifluoromethoxy)phenyl]benzenesulfonamide
InChI:
InChI=1S/C17H18F3NO4S/c18-17(19,20)25-15-7-3-13(4-8-15)14-5-9-16(10-6-14)26(23,24)21-11-1-2-12-22/h3-10,21-22H,1-2,11-12H2
InChI Key:
PPSAMQQBONEVER-UHFFFAOYSA-N
SMILES:
OCCCCNS(=O)(=O)c1ccc(cc1)c1ccc(cc1)OC(F)(F)F
Properties
Complexity:
505
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.091g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
389.389g/mol
Monoisotopic Mass:
389.091g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Literature
| Title | Journal |
|---|---|
| Development and characterization of biphenylsulfonamides as novel inhibitors of bone resorption. | Journal of medicinal chemistry 20061214 |
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