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1,2,3,4-Tetrahydro-benzo[b]azepin-5-one is a heterocyclic organic compound characterized by a seven-membered ring structure with a ketone functional group at the 5-carbon position. It belongs to the Tetrahydrobenzoazepines class of chemicals, which are known for their therapeutic value in treating various health conditions, particularly neurological disorders. However, due to limited documentation on its physical characteristics, reactivity, and toxicity, its applications and implications are not fully explored, and caution in handling is advised.

1127-74-8

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1127-74-8 Usage

Uses

Used in Pharmaceutical Industry:
1,2,3,4-Tetrahydro-benzo[b]azepin-5-one is used as a therapeutic agent for neurological disorders due to its potential health benefits and membership in the Tetrahydrobenzoazepines class of chemicals.
Used in Chemical Research:
1,2,3,4-Tetrahydro-benzo[b]azepin-5-one is used as a subject of study in chemical research to further explore its properties, reactivity, and potential applications, given its limited documentation in the literature.

Check Digit Verification of cas no

The CAS Registry Mumber 1127-74-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 1,1,2 and 7 respectively; the second part has 2 digits, 7 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 1127-74:
(6*1)+(5*1)+(4*2)+(3*7)+(2*7)+(1*4)=58
58 % 10 = 8
So 1127-74-8 is a valid CAS Registry Number.
InChI:InChI=1/C10H11NO/c12-10-6-3-7-11-9-5-2-1-4-8(9)10/h1-2,4-5,11H,3,6-7H2

1127-74-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 1,2,3,4-Tetrahydro-benzo[b]azepin-5-one

1.2 Other means of identification

Product number -
Other names 1,2,3,4-Tetrahydro-5H-1-benzazepin-5-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:1127-74-8 SDS

1127-74-8Relevant academic research and scientific papers

Practical Synthesis of N-{4-[(2-Methyl-4,5-dihydroimidazo[4,5-d][1] benzazepin-6(1H)-yl)carbonyl]phenyl}biphenyl-2-carboxamide Monohydrochloride: An Arginine Vasopressin Antagonist

Tsunoda, Takashi,Yamazaki, Atsuki,Iwamoto, Hidenori,Sakamoto, Shuichi

, p. 883 - 887 (2003)

A novel, reliable, and cost-effective synthetic route to N-{4-[(2-methyl-4,5-dihydroimidazo[4,5-d][1]benzazepin-6(1H)-yl)carbonyl] -phenyl}biphenyl-2-carboxamide monohydrochloride (1, YM087), a potent Arginine vasopressin antagonist, has been developed. Using moisture-controlled potassium carbonate, imidazole formation from α-bromoketone furnished imidazobenzazepine, avoiding potential oxazole-ring formation. Catalytic reduction of nitro imidazobenzazepine afforded the corresponding amine in high yields. Treatment of the imidazole-containing amine directly, with a carbonyl chloride, afforded the target amide circumventing protection of the imidazole.

Photochemical Fries Rearrangement of N-Phenyl-2-pyrrolidone

Ohta, Shunsaku,Sano, Atsunori,Yamashita, Masayuki,Okamoto, Masao

, p. 743 - 749 (1993)

Photochemical Fries rearrangement of 1-phenyl-2-pyrrolidone (1) proceeded smoothly in methanol especially in the presence of piperylene.Continous photo-irradiation of 1 successfully was carried out to raise the yield by utilizing a reaction mixture-circulation system containing of a spiral quartz cell, a pump, a uv light source and a column packed with appropriate absorbents for the Fries rearranged product (3) and pigments.

Benzo [b] aza-chalcone heterocomplex as well as preparation method and application thereof

-

, (2021/05/12)

The invention discloses a benzo [b] aza-chalcone heterocomplex as well as a preparation method and application thereof, and relates to the technical field of medicinal chemistry, the benzo [b] aza-chalcone heterocomplex is prepared by retaining a natural chalcone parent structure (1, 3-diphenyl propenone) with certain anti-tumor activity by adopting a medicine combination principle and meanwhile introducing a benzo [b] aza structure with a special structure type and electron cloud distribution to obtain the novel benzo [b] aza-chalcone heterocomplex; and pharmacological studies show that the compound can significantly inhibit the activity of human gastric cancer cells HGC-27, the activity of the compound is obviously higher than that of positive control cis-platinum, and meanwhile, the compound has low toxicity to human normal gastric mucosa cells GES-1 and is obviously lower than that of the positive control cis-platinum.

LIT-001, the First Nonpeptide Oxytocin Receptor Agonist that Improves Social Interaction in a Mouse Model of Autism

Frantz, Marie-Céline,Pellissier, Lucie P.,Pflimlin, Elsa,Loison, Stéphanie,Gandiá, Jorge,Marsol, Claire,Durroux, Thierry,Mouillac, Bernard,Becker, Jér?me A. J.,Le Merrer, Julie,Valencia, Christel,Villa, Pascal,Bonnet, Dominique,Hibert, Marcel

, p. 8670 - 8692 (2018/10/05)

Oxytocin (OT) and its receptor (OT-R) are implicated in the etiology of autism spectrum disorders (ASD), and OT-R is a potential target for therapeutic intervention. Very few nonpeptide oxytocin agonists have currently been reported. Their molecular and in vivo pharmacology remain to be clarified, and none of them has been shown to be efficient in improving social interaction in animal models relevant to ASD. In an attempt to rationalize the design of centrally active nonpeptide full agonists, we studied in a systematic way the structural determinants of the affinity and efficacy of representative ligands of the V1a and V2 vasopressin receptor subtypes (V1a-R and V2-R) and of the oxytocin receptor. Our results confirm the subtlety of the structure-affinity and structure-efficacy relationships around vasopressin/oxytocin receptor ligands and lead however to the first nonpeptide OT receptor agonist active in a mouse model of ASD after peripheral ip administration.

Stereochemistry of N-Benzoyl-5-substituted-1-benzazepines Revisited: Synthesis of the Conformationally Biased Derivatives and Revision of the Reported Structure

Tabata, Hidetsugu,Yoneda, Tetsuya,Tasaka, Tomohiko,Ito, Shigekazu,Oshitari, Tetsuta,Takahashi, Hideyo,Natsugari, Hideaki

, p. 3136 - 3148 (2016/05/19)

The syn (aR?,5R?) and anti (aS?,5R?) diastereomers of N-benzoyl-C5-substituted-1-benzazepines originating in the chiralities at C5 and the Ar-N(C=O) axis were first stereoselectively synthesized by biasing the conformation with a substituent at C6 and C9, respectively. Detailed examination of the stereochemistry (i.e., conformation and configuration) of these N-benzoyl-1-benzazepines by X-ray crystallographic analysis, VT NMR, and DFT calculations revealed new physicochemical aspects of these heterocycles including revision of the stereochemistry previously reported.

VASOPRESSIN V1A ANTAGONISTS

-

Page/Page column 34, (2008/06/13)

The present invention concerns compounds inter alia according to general formula 1a. Compounds according to the invention are vasopressin V 1a receptor antagonists. Pharmaceutical compositions of the compounds are useful as treatment of dysmenorrhoea.

COMPOUNDS AND METHODS FOR TREATING DYSLIPIDEMIA

-

Page/Page column 39, (2008/06/13)

Compounds of formula I wherein n, m, p, q, Y, R1 R2, R3, R4, R5, and R6 are as defined herein and their pharmaceutical compositions and methods of use are disclosed as useful for treating artherosclerosis and its sequelae.

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