CAS 21535-47-7|5-methyl-2,5-diazatetracyclo[13.4.0.0^{2,7}.0^{8,13}]nonadeca-1(15),8(13),9,11,16,18-hexaene hydrochloride|Tolvon|Mianserin hydrochloride|Norval|Bolvidon|5-methyl-2,5-diazatetracyclo[...

General Information

Structure

Molecular Formula

C₁₈H₂₁ClN₂

Molecular Mass

300.82574

Exact Mass

300.13932636

Charge

InChI

InChI=1S/C18H20N2.ClH/c1-19-10-11-20-17-9-5-3-7-15(17)12-14-6-2-4-8-16(14)18(20)13-19;/h2-9,18H,10-13H2,1H3;1H

InChIKey

YNPFMWCWRVTGKJ-UHFFFAOYSA-N

Canonic Smiles

CN1CCN2C(C1)c1ccccc1Cc1c2cccc1.Cl

Isomeric Smiles

c12N3C(c4c(Cc1cccc2)cccc4)CN(CC3)C.Cl

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

2.3987954

LogD (pH = 7.4)

3.7070787

Log P

3.8311977

Molar Refractivity

84.4987

Polarizability

32.159184

Polar Surface Area

6.48

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

Mianserin hydrochlorideTolvonNorvalBolvidon1,2,3,4,10,14b-六氢-2-甲基-二苯并[c,f]吡嗪并[1,2-a]氮杂卓盐酸盐米赛林盐酸盐Mianserin hydrochloride1,2,3,4,10,14b-Hexahydro-2-methyl-dibenzo[c,f]pyrazino[1,2-a]azepine hydrochlorideMianserine HydrochlorideLantanonAthymilMIANSERIN1,2,3,4,10,14b-Hexahydro-2-methyldibenzo[c,f]pyrazino[1,2-a]azepine HydrochlorideTolvinNSC 2922671,2,3,4,10,14beta-Hexahydro-2-methyldibenzo[c,f]pyryzino[1,2-a]azepine hydrochloride

IUPAC Traditional name

5-methyl-2,5-diazatetracyclo[13.4.0.0^{2,7}.0^{8,13}]nonadeca-1(15),8(13),9,11,16,18-hexaene hydrochloride mianserin hydrochloride 5-methyl-2,5-diazatetracyclo[13.4.0.0²,⁷.0⁸,¹³]nonadeca-1(15),8(13),9,11,16,18-hexaene hydrochloride

IUPAC name

5-methyl-2,5-diazatetracyclo[13.4.0.0^{2,7}.0^{8,13}]nonadeca-1(15),8(13),9,11,16,18-hexaene hydrochloride 5-methyl-2,5-diazatetracyclo[13.4.0.0²,⁷.0⁸,¹³]nonadeca-1(19),8,10,12,15,17-hexaene hydrochloride 5-methyl-2,5-diazatetracyclo[13.4.0.0^{2,7}.0^{8,13}]nonadeca-1(15),8,10,12,16,18-hexaene hydrochloride 5-methyl-2,5-diazatetracyclo[13.4.0.0²,⁷.0⁸,¹³]nonadeca-1(15),8(13),9,11,16,18-hexaene hydrochloride

Names and Identifiers

Registration numbers

CAS Number

21535-47-7

EC Number

244-426-7

MDL Number

MFCD00055072

PubChem SID

2427812524899455162037575

PubChem CID

68551

Registration numbers

Properties

Product Information

Salt Data

Hydrochloride

Certificate of Analysis

Download link

Grade

analytical standard, for drug analysis

Empirical Formula (Hill Notation)

C18H20N2 · HCl

Pharmacology Properties

Gene Information

human ... ADRA2A(150), ADRA2B(151), ADRA2C(152), HRH1(3269), HTR2A(3356), HTR2B(3357), HTR2C(3358)

Properties

Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

Selleck Chemicals

S1382

Research Area: Neurological Disease
Biological Activity:
Mianserin is a psychoactive drug of the tetracyclic antidepressant (TeCA) chemical class which is classified as a noradrenergic and specific serotonergic antidepressant (NaSSA) and has antidepressant, anxiolytic, hypnotic, antiemetic, orexigenic, and antihistamine effects. [1]

MP Biomedicals

02153619

Hydrochloride
Serotonin antagonist

Sigma Aldrich

M2525

Biochem/physiol Actions
Antidepressant; antagonist/inverse agonist at 5-HT2 serotonin receptors; also blocks the H1 histamine receptor and the α2 adrenoceptor.
Preparation Note
Solutions may be stored for several days at 4°C.

S100

Biochem/physiol Actions
Antidepressant; antagonist/inverse agonist at 5-HT2 serotonin receptors; also blocks the H1 histamine receptor and the α2 adrenoceptor.

TRC

M341500

Serotonin receptor antagonist. Antidepressant.

Molecule Details

References

PubChem Literature

From Data Sources

• http://en.wikipedia.org/wiki/Mianserin

• Saxena, et al.: Eur. J. Pharmacol., 13, 295 (1971)

• Brogden, R.N., et al.: Drugs, 16, 273 (1971)

• Alexander, B.S., et al.: J. Pharm. Pharmacol., 39, 664 (1987)

References

Bioactivity

PubChem BioAssay

Bioactivity

Names and Identifiers

Synonyms

IUPAC Traditional name

IUPAC name

Registration numbers

CAS Number

21535-47-7

EC Number

244-426-7

MDL Number

MFCD00055072

PubChem SID

2427812524899455162037575

PubChem CID

Molecule Details

S1382

Hydrochloride
Serotonin antagonist

Sigma Aldrich

M2525

S100

Biochem/physiol Actions
Antidepressant; antagonist/inverse agonist at 5-HT2 serotonin receptors; also blocks the H1 histamine receptor and the α2 adrenoceptor.

TRC

M341500

Serotonin receptor antagonist. Antidepressant.

References

PubChem Literature

From Data Sources

• http://en.wikipedia.org/wiki/Mianserin

• Saxena, et al.: Eur. J. Pharmacol., 13, 295 (1971)

• Brogden, R.N., et al.: Drugs, 16, 273 (1971)

• Alexander, B.S., et al.: J. Pharm. Pharmacol., 39, 664 (1987)

Bioactivity

PubChem BioAssay

Properties

Product Information

Salt Data

Hydrochloride

Certificate of Analysis

Download link

Grade

analytical standard, for drug analysis

Empirical Formula (Hill Notation)

C18H20N2 · HCl

Pharmacology Properties

Gene Information

human ... ADRA2A(150), ADRA2B(151), ADRA2C(152), HRH1(3269), HTR2A(3356), HTR2B(3357), HTR2C(3358)

Molecule

ID:72650