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PD-150606

CAT: 0013-GTR19163462-02Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19163462-02Size:200 mg
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Description
A potent and selective calpain inhibitor with Ki of 0.21 uM/0.37 uM for u-calpain/m-calpain, respectively; shows no inhibition for other proteases (cathepin B, papain, trypsin and thermolysin (Ki> 500 uM) ; attenuate shypoxic/hypoglycemic injury to cerebrocortical neurons in culture and excitotoxic injury to Purkinje cells in cerebellar slices.
CAS Number
179528-45-1
Product Name Alternative
PD 150606 | PD150606
Purity
>98% (HPLC)
Solubility
DMSO: ≥ 28 mg/mL
Smiles
O=C (O) /C (S) =C/C1=CC=C (I) C=C1
Molecular Formula
C9H7IO2S
Molecular Weight
306.1201
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
2-Propenoic acid, 3- (4-iodophenyl) -2-mercapto-, (2Z) -

Chemical Information

(2Z)-3-(4-Iodophenyl)-2-mercapto-2-propenoic acid

(Z)-3-(4-iodophenyl)-2-mercaptoacrylic acid is an organoiodine compound that is acrylic acid in which the vinylic hydrogens at positions 2 and 3 are replaced by mercapto and 4-iodophenyl groups respectively (the Z geoisomer). It has a role as an apoptosis inhibitor and a calpain inhibitor. It is a member of cinnamic acids, an organoiodine compound and a thioenol. It is functionally related to a trans-cinnamic acid.

CAS Number179528-45-1
PubChem CID9839500
IUPAC Name(Z)-3-(4-iodophenyl)-2-sulfanylprop-2-enoic acid
Molecular FormulaC9H7IO2S
Molecular Weight306.12
XLogP2.9
Topological Polar Surface Area38.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity220
SMILES
C1=CC(=CC=C1/C=C(/C(=O)O)\S)I
InChI
InChI=1S/C9H7IO2S/c10-7-3-1-6(2-4-7)5-8(13)9(11)12/h1-5,13H,(H,11,12)/b8-5-
InChIKey
DJCVSFWGKYHMKH-YVMONPNESA-N
Chemical Structure
2D Structure
2D structure of (2Z)-3-(4-Iodophenyl)-2-mercapto-2-propenoic acid
CAS: 179528-45-1
CID: 9839500
Formula: C9H7IO2S
MW: 306.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight306.12
XLogP32.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass305.92115
Monoisotopic Mass305.92115
Topological Polar Surface Area38.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity220
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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