Products for Research Use Only

Cabergoline

CAT: 0013-GTR19175073-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19175073-01Size:1 mg
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Description
Cabergoline is an ergot-derived dopamine D2-like receptor agonist with high affinity for D2, D3, and 5-HT2B receptors. It is widely used in research to study prolactinoma treatment, enabling effective hormonal and tumor control in both in vitro and in vivo experimental models.
CAS Number
81409-90-7
Product Name Alternative
DopamineReceptor, Dopamine Receptor, Dopamine D3 receptor, Dopamine D2 receptor, Dopamine, D3, D2, 5HTReceptor, 5HT Receptor, 5-HT2B, 5-HT2B receptor, Autophagy, Cabergoline, FCE21336, FCE-21336, FCE 21336, Inhibitor, inhibit
Field of Research
Cell Biology, Neuroscience, Pharmacology & Drug Discovery
Purity
97.69% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (4.43 mM) ; DMSO:260 mg/mL (575.73 mM)
Smiles
[H][C@@]12Cc3c[nH]c4cccc (c34) [C@@]1 ([H]) C[C@H] (CN2CC=C) C (=O) N (CCCN (C) C) C (=O) NCC
Molecular Formula
C26H37N5O2
Molecular Weight
451.6
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Cabergoline

Cabergoline is an N-acylurea that is (8R)-ergoline-8-carboxamide in which the hydrogen attached to the piperidine nitrogen (position 6) is substituted by an allyl group and the hydrogens attached to the carboxamide nitrogen are substituted by a 3-(dimethylamino)propyl group and an N-ethylcarbamoyl group. A dopamine D2 receptor agonist, cabergoline is used in the management of Parkinson's disease and of disorders associated with hyperprolactinaemia. It has a role as an antineoplastic agent, an antiparkinson drug and a dopamine agonist.

CAS Number81409-90-7
PubChem CID54746
IUPAC Name(6aR,9R,10aR)-N-[3-(dimethylamino)propyl]-N-(ethylcarbamoyl)-7-prop-2-enyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Molecular FormulaC26H37N5O2
Molecular Weight451.6
XLogP3.4
Topological Polar Surface Area71.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count33
Formal Charge0
Complexity713
SMILES
CCNC(=O)N(CCCN(C)C)C(=O)[C@@H]1C[C@H]2[C@@H](CC3=CNC4=CC=CC2=C34)N(C1)CC=C
InChI
InChI=1S/C26H37N5O2/c1-5-11-30-17-19(25(32)31(26(33)27-6-2)13-8-12-29(3)4)14-21-20-9-7-10-22-24(20)18(16-28-22)15-23(21)30/h5,7,9-10,16,19,21,23,28H,1,6,8,11-15,17H2,2-4H3,(H,27,33)/t19-,21-,23-/m1/s1
InChIKey
KORNTPPJEAJQIU-KJXAQDMKSA-N
Chemical Structure
2D Structure
2D structure of Cabergoline
CAS: 81409-90-7
CID: 54746
Formula: C26H37N5O2
MW: 451.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight451.6
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass451.29472544
Monoisotopic Mass451.29472544
Topological Polar Surface Area71.7 Ų
Heavy Atom Count33
Formal Charge0
Complexity713
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes