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Pardoprunox

CAT: 0498-bs-6607C-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0498-bs-6607C-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
269718-84-5
Conjugation
Unconjugated
Purity
98
Buffer
Powder
Solubility
Soluble in DMSO
Smiles
CN1CCN(CC1)C1=CC=CC2NC(=O)OC=21
Molecular Formula
C12 H15 N3 O2
Molecular Weight
233.27
InChI
InChI=1S/C12H15N3O2/c1-14-5-7-15 (8-6-14) 10-4-2-3-9-11 (10) 17-12 (16) 13-9/h2-4H,5-8H2,1H3, (H,13,16)
Storage Conditions
Store in dry, dark place at -20C for 1 year.
Shelf Life
1 year
Appearance
Solid Power.

Chemical Information

Pardoprunox

Pardoprunox has been used in trials studying the treatment of Early Stage Parkinson's Disease and Advanced Stage Parkinson's Disease. Pardoprunox is a partial dopamine D2 agonist and noradrenergic agonist with serotonin 5-HT1A agonist properties.

CAS Number269718-84-5
PubChem CID6918525
IUPAC Name7-(4-methylpiperazin-1-yl)-3H-1,3-benzoxazol-2-one
Molecular FormulaC12H15N3O2
Molecular Weight233.27
XLogP1.1
Topological Polar Surface Area44.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity302
SMILES
CN1CCN(CC1)C2=CC=CC3=C2OC(=O)N3
InChI
InChI=1S/C12H15N3O2/c1-14-5-7-15(8-6-14)10-4-2-3-9-11(10)17-12(16)13-9/h2-4H,5-8H2,1H3,(H,13,16)
InChIKey
YVPUUUDAZYFFQT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pardoprunox
CAS: 269718-84-5
CID: 6918525
Formula: C12H15N3O2
MW: 233.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight233.27
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass233.116426730
Monoisotopic Mass233.116426730
Topological Polar Surface Area44.8 Ų
Heavy Atom Count17
Formal Charge0
Complexity302
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

Alternative Products

CatalogName
GTR19162438-01Pardoprunox
TRC-P205908-10MGPardoprunox Hydrochloride
HY-14958A-01Pardoprunox (hydrochloride)
317119Pardoprunox HCl
A21624-25Pardoprunox hydrochloride 25mg
A21624-10Pardoprunox hydrochloride 10mg
AR-P30366-01Pardoprunox Impurity 1
A11538-50Pardoprunox HCl 50mg
A11538-25Pardoprunox HCl 25mg
A21624-2Pardoprunox hydrochloride 2mg

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