Basic information
- CAS
57262-94-9- Standard SMILES
CN1CCC2=C(C1)c1ccccc1Cc1ccccc12- InChIKey
GVPIXRLYKVFFMK-UHFFFAOYSA-N- Molecular formula
- C19H19N
- Average molar mass
- 261.4 g/mol
- Monoisotopic mass
- 261.15174961
Overview
Setiptiline is a tetracyclic antidepressant that is 2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine carrying a methyl group at position 2. Its maleate salt is used for the treatment of depression in Japan. It has a role as an alpha-adrenergic antagonist and a serotonergic antagonist. It is a tetracyclic antidepressant and a tertiary amino compound. It is a conjugate base of a setiptiline(1+).
Names & identifiers
- Preferred name
- Setiptiline
- IUPAC
- 4-methyl-4-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2(7),8,10,12,15,17-heptaene
- English name
- Setiptiline
- Molecular formula
- C19H19N
- Molecular weight
- 261.36
Names & synonyms
Setiptiline57262-94-9Org-8282SetiptilinaORG 8282SetiptilinumMO 8282DTXSID50205886MO-82827L38105Z6ECHEBI:13507613b,4a-carba-mianserin
Show more names
TecipulTeciptilineTeciptillineSetiptiline USP/EP/BPSetiptiline (TeciptilineSetiptiline(Teciptilline)TECIPTILLINEORG82822，3，4，9-Tetmhydro-2-methyl-1H-dibenzo[3，4：6，7]cyelohepta[1，2-c]pyridine
RefChem:1826171,2,3,4-tetrahydro-2-methyl-9H-dibenzo(3,4-6,7)cyclohepta(1,2-C)pyridineDTXCID80128377260-653-44-methyl-4-azatetracyclo(13.4.0.02,?.0?,13)nonadeca-1(19),2(7),8,10,12,15,17-heptaeneSetiptiline [INN]4-methyl-4-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2(7),8,10,12,15,17-heptaene2,3,4,9-Tetrahydro-2-methyl-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine
Database identifiers
- CAS
57262-94-9- PubChem CID
- 5205
- DTXSID
DTXSID50205886- ChEMBL
CHEMBL2104895- ChEBI
CHEBI:135076- UNII
- 7L38105Z6E
- EC Number
- 260-653-4
- Nikkaji
- J22.942C
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 397
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 120 °C · >120°C (dec.)
- Boiling point
- 421.7 · 421.7±34.0 °C(Predicted)
- Density
- 1.15 · 1.15
- storage temp.
- -20 °C · Sealed in dry,Store in freezer, under -20°C
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 8.34 · 8.34±0.20(Predicted)
- color
- White to Light Yellow
- FDA UNII
- 7 L38105Z6E · 7L38105Z6E
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Chemistry & industry
Pharmacology
PharmacodynamicsSetiptiline is a tertacyclic antidepressant. It acts to reduce the symptoms of major depressive disorder.
Mechanism of Action
Setiptiline is an antagonist at the α2 adrenergic receptor and at serotonin receptors. The antagonism of the α2 receptors likely relieves presynaptic inhibition of adrenergic neurotransmission, allowing for greater and longer sustained release of noradrenaline into the synapse. The antagonism of serotonin receptors may produce an upregulation of the receptors leading to an eventual increase in serotonergic signalling. The actual physiological mechanisms behind the antidepressant effect of setiptiline is unknown but the listed possibilities exist as likely explanations.
Applications
DescriptionSetiptiline is a mianserin analog reportedly useful in the treatment of depression with a favorable side-effect profile. It is a potent antagonist of alpha-receptors, with greater affinity at alpha, than alpha, sites, as well as an inhibitor of central serotonin receptors.
UsesSetiptiline is a tetracyclic antidepressant. Setiptiline acts as a noradrenergic and specific serotonergic antidepressant (NaSSA).
Upstream & downstream products
Upstream raw materials
Suppliers30 total
LGM Pharma1-(800)-881-8210 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Advanced chemblocks inc650-6922368 650-6922368;650-6922368 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
上海迪外化工科技有限公司021-61551100
上海喀露蓝科技有限公司18149758185 18149758185 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海皓之翔生物科技有限公司（原上海拓青化工有限公司）526763801 13301653310 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
广州市齐云生物技术有限公司020-61288194 61288195 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
成都华纯科技有限公司400-1166-196 15982826727 · [email protected]
上海立崎生物医学研究中心18014399201 · [email protected]
Musechem+1-800-259-7612 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
医恩医疗系统研发(上海)有限公司021-58958002 18930822973 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
南京法恩化学有限公司025-85710122 17714198479 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
ChemeGen 中国18818260767 · [email protected]
Baoji Guokang Healthchem Co., Ltd.+86-0917-3909592 +86-13892490616 · [email protected]
上海佰世凯生物科技有限公司021-20908456 · [email protected]
重庆卡兰医药有限公司[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海皓元医药股份有限公司021-58950125 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
Additional notes
DefinitionChEBI: Setiptiline is a tetracyclic antidepressant that is 2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine carrying a methyl group at position 2. Its maleate salt is used for the treatment of depression in Japan. It has a role as an alpha-adrenergic antagonist and a serotonergic antagonist. It is a tetracyclic antidepressant and a tertiary amino compound. It is a conjugate base of a setiptiline(1+).
Related reactions
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Compound notes
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