Molecular Identity
clomipramine
3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine
PubChem CID: 2801
Clomipramine is a dibenzoazepine that is 10,11-dihydro-5H-dibenzo[b,f]azepine which is substituted by chlorine at position 3 and in which the hydrogen attached to the nitrogen is replaced by a 3-(dimethylamino)propyl group. One of the more sedating tricyclic antidepressants, it is used as the hydrochloride salt 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, a serotonergic antagonist, a serotonin uptake inhibitor and an EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor. It is functionally related to an imipramine. It is a conjugate base of a clomipramine(1+).
2D Structure
Properties
C19H23ClN2
Molecular Formula
314.90
Molecular Weight
g/mol
314.1550
Exact Mass
Da
5.2
XLogP
Above Lipinski threshold
6.5
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
2
H-Bond Acceptors
346
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
clomipramineChlorimipramine303-49-1Monochlorimipramine3-ChloroimipramineHydiphenClomicalmClomipraminaClomipraminumAnapramine5H-Dibenz[b,f]azepine-5-propanamine, 3-chloro-10,11-dihydro-N,N-dimethyl-3-Chloro-Iminodibenzyl3-Chloro-5-(3-(dimethylamino)propyl)-10,11-dihydro-5H-dibenz(b,f)azepineNSC-169865NUV44L116D
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to clomipramine
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