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52960-14-2 | 1-PENTANESULFONAMIDE
CAS No: 52960-14-2 Catalog No: AG00E2TL MDL No:MFCD09800672
Product Description
Catalog Number:
AG00E2TL
Chemical Name:
1-PENTANESULFONAMIDE
CAS Number:
52960-14-2
Molecular Formula:
C5H13NO2S
Molecular Weight:
151.2272
MDL Number:
MFCD09800672
IUPAC Name:
pentane-1-sulfonamide
InChI:
InChI=1S/C5H13NO2S/c1-2-3-4-5-9(6,7)8/h2-5H2,1H3,(H2,6,7,8)
InChI Key:
ICFQGMYPBURXAZ-UHFFFAOYSA-N
SMILES:
CCCCCS(=O)(=O)N
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.067g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.224g/mol
Monoisotopic Mass:
151.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| Structure-activity relationships and key structural feature of pyridyloxybenzene-acylsulfonamides as new, potent, and selective peroxisome proliferator-activated receptor (PPAR) γ Agonists. | Bioorganic & medicinal chemistry 20120515 |
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