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7-BROMO-1,3,4,5-TETRAHYDRO-BENZO[B]AZEPIN-2-ONE is a heterocyclic chemical compound with the molecular formula C9H10BrNO. It features a benzene ring fused to an azepine ring, with a bromine atom attached to the benzene ring and a ketone functional group on the azepine ring. 7-BROMO-1,3,4,5-TETRAHYDRO-BENZO[B]AZEPIN-2-ONE is utilized in various fields, particularly in organic synthesis and pharmaceutical research, where it serves as a building block for the development of pharmacologically active compounds.

53841-99-9

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53841-99-9 Usage

Uses

Used in Pharmaceutical Research:
7-BROMO-1,3,4,5-TETRAHYDRO-BENZO[B]AZEPIN-2-ONE is used as a building block for the synthesis of various pharmacologically active compounds. Its unique structure and functional groups make it a valuable intermediate in the development of new drugs with potential therapeutic applications.
Used in Organic Synthesis:
In the field of organic synthesis, 7-BROMO-1,3,4,5-TETRAHYDRO-BENZO[B]AZEPIN-2-ONE is used as a reagent for the preparation of diverse chemical compounds. Its bromine atom and ketone functional group provide opportunities for further chemical reactions and modifications, enabling the creation of a wide range of molecules with different properties and applications.
Used in Agrochemical Production:
7-BROMO-1,3,4,5-TETRAHYDRO-BENZO[B]AZEPIN-2-ONE also serves as an intermediate in the production of agrochemicals. Its potential applications in this industry include the development of new pesticides, herbicides, and other agricultural chemicals that can improve crop yields and protect plants from pests and diseases.
The specific properties and applications of 7-BROMO-1,3,4,5-TETRAHYDRO-BENZO[B]AZEPIN-2-ONE may vary depending on its purity, concentration, and form. Its versatility in different industries highlights the importance of 7-BROMO-1,3,4,5-TETRAHYDRO-BENZO[B]AZEPIN-2-ONE in the development of new and innovative products.

Check Digit Verification of cas no

The CAS Registry Mumber 53841-99-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,3,8,4 and 1 respectively; the second part has 2 digits, 9 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 53841-99:
(7*5)+(6*3)+(5*8)+(4*4)+(3*1)+(2*9)+(1*9)=139
139 % 10 = 9
So 53841-99-9 is a valid CAS Registry Number.
InChI:InChI=1/C10H10BrNO/c11-8-4-5-9-7(6-8)2-1-3-10(13)12-9/h4-6H,1-3H2,(H,12,13)

53841-99-9SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 7-bromo-1,3,4,5-tetrahydro-1-benzazepin-2-one

1.2 Other means of identification

Product number -
Other names 7-bromo-1,3,4,5-tetrahydro-2H-benzo[b]azepin-2-one

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:53841-99-9 SDS

53841-99-9Relevant academic research and scientific papers

New V1a receptor antagonist. Part 2. Identification and optimization of triazolobenzazepines

Baska, Ferenc,Bata, Imre,Bozó, éva,Domány-Kovács, Katalin,Kurkó, Dalma,L?vei, Klára,Szántó, Gábor,Szokoli, Teodóra,Szondiné Kordás, Krisztina

, (2020)

Solid preclinical evidence links vasopressin to social behavior in animals, so, extensive work has been initiated to find new vasopressin V1a receptor antagonists which can improve deteriorated social behavior in humans and can treat the core symptoms of autistic behavior, as well. Our aim was to identify new chemical entities with antagonizing effects on vasopressin V1a receptors. Continuing our previous work, we found an in vitro and in vivo orally active V1a selective antagonist molecule (40) among [1,2,4]triazolo[4,3-a][1]benzazepines.

LPA RECEPTOR ANTAGONISTS AND USES THEREOF

-

, (2021/12/17)

The present disclosure relates generally to compounds that bind to Lysophosphatidic Acid Receptor 1 (LPAR1) and act as antagonists of LPAR1. The disclosure further relates to the use of the compounds for the preparation of a medicament for the treatment of diseases and/or conditions through binding of LPAR1, including fibrosis and liver diseases such as non alcoholic steatohepatitis (NASH).

Triazole derivative having HSP90 (Heat Shock Protein) inhibiting activity, as well as preparation method and application of triazole derivative

-

Paragraph 0217; 0218; 0219; 0220, (2017/08/02)

The invention discloses a triazole derivative having an HSP90 (Heat Shock Protein) inhibiting activity, as well as a preparation method and an application of the triazole derivative. Specifically, the invention relates to the triazole derivative having a structure as shown in a formula (I), a stereisomer of the triazole derivative and a pharmaceutically acceptable salt, wherein the definition of each substituent group in the formula (I) and the definition in a description are the same. The compound with a novel structure has the HSP90 inhibiting activity, can be used to cure cancers, neurodegenerative disorders, inflammation diseases, autoimmune diseases, ischemic brain injuries and the like, and has a broad application prospect.

ALDOSTERONE SYNTHASE INHIBITORS

-

, (2012/11/13)

This invention relates to tricyclic triazole analogues of the formula I or their pharmaceutically acceptable salts, wherein the variable are defined herein. The inventive compounds selectively inhibit aldosterone synthetase. This invention also provides for pharmaceutical compositions comprising the compounds of Formula I or their salts as well as to methods for the treatment, amelioration or prevention of conditions that could be treated by inhibiting aldosterone synthetase.

Targeting the polyamine transport system with benzazepine- and azepine-polyamine conjugates

Tomasi, Sophie,Renault, Jacques,Martin, Bénédicte,Duhieu, Stephane,Cerec, Virginie,Le Roch, Myriam,Uriac, Philippe,Delcros, Jean-Guy

experimental part, p. 7647 - 7663 (2011/02/22)

The polyamine transport system (PTS) whose activity is up-regulated in cancer cells is an attractive target for drug design. Two heterocyclic (azepine and benzazepine) systems were conjugated to various polyamine moieties through an amidine bound to afford 18 compounds which were evaluated for their affinity for the PTS and their ability to use the PTS for cell delivery. Structure-activity relationship studies and lead optimization afforded two attractive PTS targeting compounds. The azepine-spermidine conjugate 14 is a very selective substrate of the PTS that may serve as a vector for radioelements used for diagnoses or therapeutics in nuclear medicine. The nitrobenzazepine-spermine conjugate 28 is a very powerful PTS inhibitor with very low intrinsic cytotoxicity, able to prevent the growth of polyamine depleted cells in presence of exogenous polyamines.

LXR modulators

-

Page/Page column 62-63, (2010/11/26)

A compound of formula I wherein A, X, q, R1, R2a, R2b, R2c, R3a, and R3b are defined herein.

COMPOUNDS, COMPOSITIONS AND METHODS

-

Page/Page column 51, (2010/11/24)

Compounds useful for treating cellular proliferative diseases and disorders by modulating the activity of KSP are disclosed.

Lipoxygenase Inhibitors, III: Synthesis of Tetrahydrobenzazepinone Phenylhydrazones

Buege, Axel,Locke, Christian,Koehler, Thomas,Nuhn, Peter

, p. 99 - 104 (2007/10/02)

Tetrahydro-2H-benzazepin-2-ones as starting substances are synthesized by Beckmann rearrangement or Schmidt reaction.The tetrahydrobenzazepinones are transformed into the thiones, thiolactim ethers and phenylhydrazones.The compounds are tested as inhibitors of soja lipoxygenase.

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