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Tetrindole (hydrochloride)

CAT: 0804-HY-101169ASize: 1 EachDry Ice: NoHazardous: No
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Description
Tetrindole hydrochloride is a selective inhibitor of monoamine oxidase A (MAO A) . Tetrindole hydrochloride inhibits rat brain mitochondrial MAO A in a competitive manner with a Ki value of 0.4 μM and inhibits MAO B with a Ki of 110 μM. Tetrindole hydrochloride has antidepressant activity[1][2].
CAS Number
135991-95-6
UNSPSC
12352005
Target
Monoamine Oxidase
Related Pathways
Neuronal Signaling
Applications
Neuroscience-Neuromodulation
Field of Research
Neurological Disease
Smiles
C12=C(C3=C4N2CCNC4CCC3)C=C(C5CCCCC5)C=C1.Cl
Molecular Formula
C20H27ClN2
Molecular Weight
330.89
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
MAO-A

Chemical Information

Tetrindole

Tetrindole hydrochloride is a racemate composed of equimolar amounts of (R)- and (S)-tetrindole hydrochloride. It has a role as an antidepressant, a serotonergic agonist and an EC 1.4.3.4 (monoamine oxidase) inhibitor. It contains a (R)-tetrindole hydrochloride and a (S)-tetrindole hydrochloride.

CAS Number135991-95-6
PubChem CID160019
IUPAC Name12-cyclohexyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraene;hydrochloride
Molecular FormulaC20H27ClN2
Molecular Weight330.9
Topological Polar Surface Area17
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count23
Formal Charge0
Complexity403
SMILES
C1CCC(CC1)C2=CC3=C(C=C2)N4CCNC5C4=C3CCC5.Cl
InChI
InChI=1S/C20H26N2.ClH/c1-2-5-14(6-3-1)15-9-10-19-17(13-15)16-7-4-8-18-20(16)22(19)12-11-21-18;/h9-10,13-14,18,21H,1-8,11-12H2;1H
InChIKey
NDSGWNVNYIVEKU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tetrindole
CAS: 135991-95-6
CID: 160019
Formula: C20H27ClN2
MW: 330.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight330.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass330.1862766
Monoisotopic Mass330.1862766
Topological Polar Surface Area17 Ų
Heavy Atom Count23
Formal Charge0
Complexity403
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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