Products for Research Use Only
RegisterLogin

Repinotan (hydrochloride)

CAT: 0804-HY-12959A-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-12959A-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Repinotan hydrochloride (BAY x 3702) is a potent, selective, brain-penetrant and orally active 5-HT1A receptor agonist, with Ki values of 0.19 nM (calf hippocampus), 0.25 nM (rat and human cortex), and 0.59 nM (rat hippocampus Repinotan hydrochloride has a weak affinity for other related receptors. Repinotan hydrochloride has pronounced neuroprotective effects[1].
CAS Number
144980-77-8
Product Name Alternative
BAY x 3702
UNSPSC
12352005
Target
5-HT Receptor
Type
Reference compound
Related Pathways
GPCR/G Protein; Neuronal Signaling
Applications
Neuroscience-Neuromodulation
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/repinotan-hydrochloride.html
Purity
97.08
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
O=C(C1=C2C=CC=C1)N(CCCCNC[C@H]3CCC4=CC=CC=C4O3)S2(=O)=O.[H]Cl
Molecular Formula
C21H25ClN2O4S
Molecular Weight
436.95
References & Citations
[1]A C Berends, et al. A review of the neuroprotective properties of the 5-HT1A receptor agonist repinotan HCl (BAYx3702) in ischemic stroke. CNS Drug Rev. Winter 2005;11 (4) :379-402.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, sealed storage, away from moisture)
Scientific Category
Reference compound1
Clinical Information
Phase 2
Isoform
5-HT1 Receptor

Chemical Information

Repinotan hydrochloride

5-HT(1A) receptor agonist; structure in first source

CAS Number144980-77-8
PubChem CID198756
IUPAC Name2-[4-[[(2R)-3,4-dihydro-2H-chromen-2-yl]methylamino]butyl]-1,1-dioxo-1,2-benzothiazol-3-one;hydrochloride
Molecular FormulaC21H25ClN2O4S
Molecular Weight437.0
Topological Polar Surface Area84.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count29
Formal Charge0
Complexity647
SMILES
C1CC2=CC=CC=C2O[C@H]1CNCCCCN3C(=O)C4=CC=CC=C4S3(=O)=O.Cl
InChI
InChI=1S/C21H24N2O4S.ClH/c24-21-18-8-2-4-10-20(18)28(25,26)23(21)14-6-5-13-22-15-17-12-11-16-7-1-3-9-19(16)27-17;/h1-4,7-10,17,22H,5-6,11-15H2;1H/t17-;/m1./s1
InChIKey
IGKYREHZJIHPML-UNTBIKODSA-N
Chemical Structure
2D Structure
2D structure of Repinotan hydrochloride
CAS: 144980-77-8
CID: 198756
Formula: C21H25ClN2O4S
MW: 437.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight437.0
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass436.1223562
Monoisotopic Mass436.1223562
Topological Polar Surface Area84.1 Ų
Heavy Atom Count29
Formal Charge0
Complexity647
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-12959Repinotan
HY-106973A-01Nolomirole (hydrochloride)
HY-107133-01Simmitecan (hydrochloride)
HY-Z18056-01Norpropranolol (hydrochloride)
HY-W741706Butopamine (hydrochloride)
HY-W424017A-01Lophophine (hydrochloride)
HY-N0584BAnisodamine (hydrochloride)
HY-N3359BLupanine (hydrochloride)
HY-B1717AOxolamine (hydrochloride)
HY-B0168A-01Milnacipran (hydrochloride)

Alternative Products

CatalogName
TRC-R144545-50MGRepinotan Hydrochloride
T61934-01Repinotan
GTR19196637-01Repinotan HCl
300563Ligustrazine Hydrochloride (Chuanxiongzine hydrochloride)
D3190-91GDeoxynojirimycin Hydrochloride (DNJ Hydrochloride)
OR1043462-01Hydrochloride
MBS6103001-01O-Cyclopropylmethyl-hydroxylamine, Hydrochloride (Cyclopropylmethoxyamine, Hydrochloride, Cyclopropylmethoxylamine, Hydrochloride)
C7050-01Cysteamine hydrochloride; 2-AminoeThanethiol Hydrochloride; 2-Aminoethane-1-Thiol Hydrochloride; Mercaptamine Hydrochloride
P9050-45Propargylamine, Hydrochloride (2-Propynylamine, Hydrochloride)
46264200Thiamine hydrochloride (Vitamin B1 hydrochloride)

Popular Products