Products for Research Use Only

PHCCC

CAT: 0013-GTR19172267-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19172267-01Size:2 mg
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Description
PHCCC is a small molecule that acts as a positive allosteric modulator of mGluR4 and an antagonist for Group I mGluRs, mGluR2, and mGluR8. It is a research tool used in vitro and in vivo to investigate neurological disorders such as Parkinson's disease and anxiety.
CAS Number
179068-02-1
Product Name Alternative
Disease, allosteric, (-) PHCCC, Inhibitor, inhibit, Parkinson's, Metabotropic glutamate receptors, mGluR, mGluR1, neurons, neuroprotective, PHCCC
Field of Research
Neuroscience
Purity
99.31% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:1 mg/mL (3.4 mM) ; DMSO:55 mg/mL (186.88 mM)
Smiles
C (NC1=CC=CC=C1) (=O) C23C (C2) C (=NO) C=4C (O3) =CC=CC4
Molecular Formula
C17H14N2O3
Molecular Weight
294.3
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Phccc

7-hydroxyimino-N-phenyl-1,7a-dihydrocyclopropa[b][1]benzopyran-1a-carboxamide is a 1-benzopyran.

CAS Number179068-02-1
PubChem CID5866327
IUPAC Name(7E)-7-hydroxyimino-N-phenyl-1,7a-dihydrocyclopropa[b]chromene-1a-carboxamide
Molecular FormulaC17H14N2O3
Molecular Weight294.30
XLogP2.6
Topological Polar Surface Area70.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity486
SMILES
C1C\2C1(OC3=CC=CC=C3/C2=N/O)C(=O)NC4=CC=CC=C4
InChI
InChI=1S/C17H14N2O3/c20-16(18-11-6-2-1-3-7-11)17-10-13(17)15(19-21)12-8-4-5-9-14(12)22-17/h1-9,13,21H,10H2,(H,18,20)/b19-15-
InChIKey
FPXPIEZPAXSELW-CYVLTUHYSA-N
Chemical Structure
2D Structure
2D structure of Phccc
CAS: 179068-02-1
CID: 5866327
Formula: C17H14N2O3
MW: 294.30
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight294.30
XLogP32.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass294.10044231
Monoisotopic Mass294.10044231
Topological Polar Surface Area70.9 Ų
Heavy Atom Count22
Formal Charge0
Complexity486
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes