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Rotigotine-

CAT: 0931-T6647-05Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T6647-05Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
99755-59-6
Target
Dopamine Receptor, 5-HT Receptor, Adrenergic Receptor
Related Pathways
Neuroscience, GPCR/G Protein
Purity
0.9976
Bioactivity
Rotigotine (N-0923) is a non-ergot dopamine receptor agonist used in the therapy of Parkinson disease and restless leg syndrome. Administered as a once-daily transdermal patch, Rotigotine has not been associated with serum enzyme elevations during treatment or with episodes of clinically apparent liver injury.
Smiles
OC1=C2C(C[C@@H](N(CCC3=CC=CS3)CCC)CC2)=CC=C1
Molecular Formula
C19H25NOS
Molecular Weight
315.47
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Rotigotine

Rotigotine is a member of tetralins.

CAS Number99755-59-6
PubChem CID59227
IUPAC Name(6S)-6-[propyl(2-thiophen-2-ylethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
Molecular FormulaC19H25NOS
Molecular Weight315.5
XLogP4.9
Topological Polar Surface Area51.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count22
Formal Charge0
Complexity337
SMILES
CCCN(CCC1=CC=CS1)[C@H]2CCC3=C(C2)C=CC=C3O
InChI
InChI=1S/C19H25NOS/c1-2-11-20(12-10-17-6-4-13-22-17)16-8-9-18-15(14-16)5-3-7-19(18)21/h3-7,13,16,21H,2,8-12,14H2,1H3/t16-/m0/s1
InChIKey
KFQYTPMOWPVWEJ-INIZCTEOSA-N
Chemical Structure
2D Structure
2D structure of Rotigotine
CAS: 99755-59-6
CID: 59227
Formula: C19H25NOS
MW: 315.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight315.5
XLogP34.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass315.16568559
Monoisotopic Mass315.16568559
Topological Polar Surface Area51.7 Ų
Heavy Atom Count22
Formal Charge0
Complexity337
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
RM-R152000-01Rotigotine
BUP15521-01Rotigotine-
HY-A0007-01Rotigotine (Hydrochloride)
HY-15394A-01(Rac) -Rotigotine

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