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PTP Inhibitor IV

CAT: 1410-M33787-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M33787-01Size:5 mg
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Description
PTP Inhibitor IV is an effective protein tyrosine phosphatase (PTP) inhibitor, which can selectively inhibit DUSP14 phosphatase activity (IC50.5.21μm) . PTP Inhibitor IV inhibited SHP-2, PTP1B, PTp-ε, PTP Meg-2, PTP-σ, PTP-β and PTP-μ, IC50 were 1.8 μM, 2.5 μM, 8.4 μM, 13 μM, 20 μM, 6.4 μM, and 6.7 μM, respectively. PTP Inhibitor IV affects cellular signaling by inhibiting PTP activity and may regulate specific pathways associated with PTP-mediated signaling events.
CAS Number
329317-98-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
608.62
Molecular Formula
C26H26F6N2O4S2
Notes
Research use only, not for human use.
Receptor
Phosphatase

Chemical Information

PTP Inhibitor IV
CAS Number329317-98-8
PubChem CID6420094
IUPAC Name1,1,1-trifluoro-N-[4-[2-[4-[2-[4-(trifluoromethylsulfonylamino)phenyl]propan-2-yl]phenyl]propan-2-yl]phenyl]methanesulfonamide
Molecular FormulaC26H26F6N2O4S2
Molecular Weight608.6
XLogP7.9
Topological Polar Surface Area109
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count12
Rotatable Bond Count8
Heavy Atom Count40
Formal Charge0
Complexity968
SMILES
CC(C)(C1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)NS(=O)(=O)C(F)(F)F)C3=CC=C(C=C3)NS(=O)(=O)C(F)(F)F
InChI
InChI=1S/C26H26F6N2O4S2/c1-23(2,19-9-13-21(14-10-19)33-39(35,36)25(27,28)29)17-5-7-18(8-6-17)24(3,4)20-11-15-22(16-12-20)34-40(37,38)26(30,31)32/h5-16,33-34H,1-4H3
InChIKey
JWNAVYMNAQDLHX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of PTP Inhibitor IV
CAS: 329317-98-8
CID: 6420094
Formula: C26H26F6N2O4S2
MW: 608.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight608.6
XLogP37.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count12
Rotatable Bond Count8
Exact Mass608.12381863
Monoisotopic Mass608.12381863
Topological Polar Surface Area109 Ų
Heavy Atom Count40
Formal Charge0
Complexity968
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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