sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks Ptp1b-in-1

Ptp1b-in-1

CAS No.:
612530-44-6
Catalog Number:
AG00ECFO
Molecular Formula:
C8H8N2O3S
Molecular Weight:
212.2257
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$640
- +
10mg
99%
1 week
United States
$890
- +
50mg
99%
1 week
United States
$2557
- +
100mg
99%
1 week
United States
$3557
- +
Product Description
Catalog Number:
AG00ECFO
Chemical Name:
Ptp1b-in-1
CAS Number:
612530-44-6
Molecular Formula:
C8H8N2O3S
Molecular Weight:
212.2257
MDL Number:
MFCD18206847
IUPAC Name:
1,1-dioxo-5-phenyl-1,2,5-thiadiazolidin-3-one
InChI:
InChI=1S/C8H8N2O3S/c11-8-6-10(14(12,13)9-8)7-4-2-1-3-5-7/h1-5H,6H2,(H,9,11)
InChI Key:
LDCZCUKQWRZSDT-UHFFFAOYSA-N
SMILES:
O=C1CN(S(=O)(=O)N1)c1ccccc1
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.026g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.223g/mol
Monoisotopic Mass:
212.026g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Literature
Title Journal
Using small molecules to target protein phosphatases. Bioorganic & medicinal chemistry 20110401
Recent advances in the discovery of competitive protein tyrosine phosphatase 1B inhibitors for the treatment of diabetes, obesity, and cancer. Journal of medicinal chemistry 20100325
Structure-based design of protein tyrosine phosphatase-1B inhibitors. Bioorganic & medicinal chemistry letters 20050516
Properties