Brexpiprazole | CAS No. 913611-97-9

Brexpiprazole

Basic Information

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CAS Number

913611-97-9

Molecular Formula

C25H27N3O2S

Molecular Weight

433.58 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Boiling Point

675.2°C at 760 mmHg

SMILES

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C1CN(CCN1CCCCOC2=CC3=C(C=C2)C=CC(=O)N3)C4=C5C=CSC5=CC=C4

InChI

InChI=1S/C25H27N3O2S/c29-25-9-7-19-6-8-20(18-22(19)26-25)30-16-2-1-11-27-12-14-28(15-13-27)23-4-3-5-24-21(23)10-17-31-24/h3-10,17-18H,1-2,11-16H2,(H,26,29)

InChIKey

ZKIAIYBUSXZPLP-UHFFFAOYSA-N

LogP

4.724000000000004

Topological Polar Surface Area

48.57 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

636

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Brexpiprazole
7-(4-(4-(Benzo[b]thiophen-4-yl)piperazin-1-yl)butoxy)quinolin-2(1H)-one
7-?[4-?(4-?benzo[b]?thien-?4-?yl-?1-?piperazinyl)?butoxy]?-2(1H)?-?Quinolinone
7-[4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butoxy]-1H-quinolin-2-one
OPC 34712
OPC-34712
UNII-2J3YBM1K8C
2J3YBM1K8C
AK171366
Rexulti
Brexpiprazole [USAN:INN]
Rxulti
Rexulti (TN)
Brexpiprazole.2H2O
7-(4-(4-(1-Benzothiophen-4-yl)piperazin-1-yl)butoxy)quinolin-2(1H)-one
Brexpiprazole(OPC34712)
GTPL7672
Brexpiprazole (JAN/USAN/INN)
7-[4-(4-Benzo[b]thien-4-yl-1-piperazinyl)butoxy]-2(1H)-quinolinone (ACI)
7-[4-(4-(Benzo[b]thien-4-yl)-piperazin-1-yl)butoxy]-1H-quinolin-2-one
BREXPIPRAZOLE [JAN]
EX-A2639
AKOS037515802
HMS3885P12
BCP10218
NCGC00378574-02
AS-56467
7-[4-(4-benzo[b]thiophen-4-yl-piperazin-1-yl)butoxy]-1H-quinolin-2-one
AC-30404
SY047420
2(1H)-Quinolinone, 7-(4-(4-benzo(b)thien-4-yl-1-piperazinyl)butoxy)-

MDL Number

MFCD27987920

FAQ

What is Brexpiprazole (CAS: 913611-97-9)?

Brexpiprazole (CAS: 913611-97-9) is a selective serotonin receptor modulator (SSRMs) used primarily in the treatment of psychiatric disorders. It has the chemical formula C20H23FN4O and is known for its partial agonist activity at serotonin 5-HT1A receptors and antagonist activity at serotonin 5-HT2A receptors. This unique pharmacological profile makes it a valuable compound in modern psychopharmacology.

What are the main uses of Brexpiprazole (CAS: 913611-97-9)?

Brexpiprazole (CAS: 913611-97-9) is primarily used as a treatment for schizophrenia and major depressive disorder. It is also being explored for its potential in managing other mental health conditions such as anxiety and bipolar disorder. Its mechanism of action involves modulating serotonin receptor activity to improve symptoms of these disorders.

Is Brexpiprazole (CAS: 913611-97-9) safe?

Brexpiprazole (CAS: 913611-97-9) is generally considered safe when used as directed, but like all medications, it may cause side effects. Common side effects include dizziness, somnolence, and weight changes. It is important to follow medical guidelines and consult healthcare professionals for proper handling and use. Safety standards are in place to ensure its appropriate application in clinical settings.

How should Brexpiprazole (CAS: 913611-97-9) be stored?

Brexpiprazole (CAS: 913611-97-9) should be stored in a cool, dry place away from direct light. It is typically kept at a temperature between 15°C and 30°C (59°F and 86°F). Proper storage ensures its stability and effectiveness. Keep the container tightly closed and ensure it is out of reach of children and unauthorized personnel.