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N-Despropyl Ropinirole

CAT: 0804-HY-W329175-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W329175-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
N-Despropyl Ropinirole (SKF-104557) is an active metabolite of the dopamine D2 receptor agonist Ropinirole. N-Despropyl Ropinirole is a full agonist at human D2 and D3 receptors. N-Despropyl Ropinirole is a partial agonistof the hD4 receptor[1].
CAS Number
106916-16-9
Product Name Alternative
SKF-104557
UNSPSC
12352005
Hazard Statement
H302
Target
Dopamine Receptor; Drug Metabolite
Type
Reference compound
Related Pathways
GPCR/G Protein; Metabolic Enzyme/Protease; Neuronal Signaling
Applications
Neuroscience-Neuromodulation
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/n-despropyl-ropinirole.html
Solubility
10 mM in DMSO
Smiles
CCCNCCC1=C2CC(NC2=CC=C1)=O
Molecular Formula
C13H18N2O
Molecular Weight
218.29
Precautions
P264-P270-P330-P501
References & Citations
[1]Coldwell MC, et al. Comparison of the functional potencies of ropinirole and other dopamine receptor agonists at human D2 (long), D3 and D4.4 receptors expressed in Chinese hamster ovary cells. Br J Pharmacol. 1999 Aug;127 (7) :1696-702.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Skf-104557

N-despropyl ropinirole is a member of indoles.

CAS Number106916-16-9
PubChem CID10398490
IUPAC Name4-[2-(propylamino)ethyl]-1,3-dihydroindol-2-one
Molecular FormulaC13H18N2O
Molecular Weight218.29
XLogP1.3
Topological Polar Surface Area41.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count16
Formal Charge0
Complexity242
SMILES
CCCNCCC1=C2CC(=O)NC2=CC=C1
InChI
InChI=1S/C13H18N2O/c1-2-7-14-8-6-10-4-3-5-12-11(10)9-13(16)15-12/h3-5,14H,2,6-9H2,1H3,(H,15,16)
InChIKey
VKDWFHAQOZYATG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Skf-104557
CAS: 106916-16-9
CID: 10398490
Formula: C13H18N2O
MW: 218.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight218.29
XLogP31.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass218.141913202
Monoisotopic Mass218.141913202
Topological Polar Surface Area41.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity242
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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