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Clomipramine HCl

CAT: 0957-S2541-1gSize: 1 gDry Ice: YesHazardous: No
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CAT#:0957-S2541-1gSize:1 g
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CAS Number
17321-77-6
Synonyms
Anafranil
Target
Serotonin Transporter
Applications
Neuronal Signaling
Smiles
CN (C) CCCN1C2=CC=CC=C2CCC3=C1C=C (C=C3) Cl.Cl
Molecular Formula
C19H23ClN2.HCl
Additionnal Information
Clomipramine HCl is a tricyclic antidepressant acting as a potent inhibitor of 5-HT reuptake with an IC50 value of 1.5 nM. Clomipramine hydrochloride is used in research on depression, anxiety, and obsessive-compulsive disorder (OCD) .
Storage Conditions
2 years -80 in solvent

Chemical Information

Clomipramine Hydrochloride

Clomipramine hydrochloride is a hydrochloride resulting from the reaction of equimolar amounts of clomipramine and hydrogen chloride. One of the more sedating tricyclic antidepressants, it is used for the treatment of depression as well as obsessive-compulsive disorder and phobias. It has a role as an anticoronaviral agent, an antidepressant, a serotonergic drug and a serotonergic antagonist. It contains a clomipramine(1+).

CAS Number17321-77-6
PubChem CID68539
IUPAC Name3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine;hydrochloride
Molecular FormulaC19H24Cl2N2
Molecular Weight351.3
Topological Polar Surface Area6.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity346
SMILES
CN(C)CCCN1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl.Cl
InChI
InChI=1S/C19H23ClN2.ClH/c1-21(2)12-5-13-22-18-7-4-3-6-15(18)8-9-16-10-11-17(20)14-19(16)22;/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3;1H
InChIKey
WIMWMKZEIBHDTH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Clomipramine Hydrochloride
CAS: 17321-77-6
CID: 68539
Formula: C19H24Cl2N2
MW: 351.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight351.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass350.1316542
Monoisotopic Mass350.1316542
Topological Polar Surface Area6.5 Ų
Heavy Atom Count23
Formal Charge0
Complexity346
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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