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PG01

CAT: 0804-HY-103369-04Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-103369-04Size:10 mg
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Description
PG01 is a potent CFTR Cl- channel potentiator. PG01 can correct gating defects of CFTR mutants, is effective on b>E193K, G970R and G551D (CFTR mutants) with Kd values of 0.22 μM, 0.45 μM and 1.94 μM, respectively. PG01 is also effective on ΔF508 (Ka of 0.3 μM) . PG01 increases ΔF508-CFTR Cl- current after adding Forskolin[1][2].
CAS Number
853138-65-5
UNSPSC
12352005
Hazard Statement
H302, H413
Target
CFTR
Type
Reference compound
Related Pathways
Membrane Transporter/Ion Channel
Applications
Neuroscience-Neuromodulation
Field of Research
Endocrinology
Assay Protocol
https://www.medchemexpress.com/pg01.html
Concentration
10mM
Purity
98.04
Solubility
DMSO : 43.96 mg/mL (ultrasonic)
Smiles
O=C(N(C)C(C1=CC=CC=C1)C(NC2=CC=C(C(C)C)C=C2)=O)CC3=CNC4=C3C=CC=C4
Molecular Formula
C28H29N3O2
Molecular Weight
439.55
Precautions
H302, H413
References & Citations
[1]Pedemonte N, et al. Phenylglycine and sulfonamide correctors of defective delta F508 and G551D cystic fibrosis transmembrane conductance regulator chloride-channel gating. Mol Pharmacol. 2005 May;67 (5) :1797-807.|[2]Caputo A, et al. Mutation-specific potency and efficacy of cystic fibrosis transmembrane conductance regulator chloride channel potentiators. J Pharmacol Exp Ther. 2009 Sep;330 (3) :783-91.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C, 3 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Phenylglycine-01
CAS Number853138-65-5
PubChem CID4695397
IUPAC Name2-[[2-(1H-indol-3-yl)acetyl]-methylamino]-2-phenyl-N-(4-propan-2-ylphenyl)acetamide
Molecular FormulaC28H29N3O2
Molecular Weight439.5
XLogP5.2
Topological Polar Surface Area65.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Heavy Atom Count33
Formal Charge0
Complexity652
SMILES
CC(C)C1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)N(C)C(=O)CC3=CNC4=CC=CC=C43
InChI
InChI=1S/C28H29N3O2/c1-19(2)20-13-15-23(16-14-20)30-28(33)27(21-9-5-4-6-10-21)31(3)26(32)17-22-18-29-25-12-8-7-11-24(22)25/h4-16,18-19,27,29H,17H2,1-3H3,(H,30,33)
InChIKey
PQAYCXMQTUEDRD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Phenylglycine-01
CAS: 853138-65-5
CID: 4695397
Formula: C28H29N3O2
MW: 439.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight439.5
XLogP35.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Exact Mass439.22597718
Monoisotopic Mass439.22597718
Topological Polar Surface Area65.2 Ų
Heavy Atom Count33
Formal Charge0
Complexity652
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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