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123227-23-6

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123227-23-6 Usage

Molecular structure

A complex compound with a dibenzo[b,e]oxepine core and additional functional groups.

Carboxylic acid group

Contains a carboxylic acid functional group, which can form hydrogen bonds and participate in various chemical reactions.

Sulfanyl group

Contains a sulfanyl (-SH) group, which can form disulfide bonds and participate in redox reactions.

Methoxyphenylcarbonylaminoethyl group

Contains a 2-methoxyphenylcarbonylaminoethyl group, which adds complexity to the molecule and may influence its properties and potential applications.

Potential applications

May have potential pharmaceutical or industrial applications due to its unique structure and functional groups.

Further research needed

Specific uses and properties would need to be determined through further research and testing.

Hydrophobicity

The presence of the dibenzo[b,e]oxepine core and the methoxyphenyl group may contribute to the hydrophobic nature of the molecule.

Aromaticity

The dibenzo[b,e]oxepine core and the methoxyphenyl group are aromatic, which may influence the molecule's stability and reactivity.

Chirality

The molecule may contain chiral centers, which could result in different stereoisomers with distinct properties and potential applications.

Solubility

The presence of the carboxylic acid group may increase solubility in polar solvents, while the hydrophobic groups may decrease solubility in nonpolar solvents.

Reactivity

The presence of various functional groups may make the molecule reactive towards a range of reagents, depending on the specific reaction conditions.

Check Digit Verification of cas no

The CAS Registry Mumber 123227-23-6 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,2,3,2,2 and 7 respectively; the second part has 2 digits, 2 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 123227-23:
(8*1)+(7*2)+(6*3)+(5*2)+(4*2)+(3*7)+(2*2)+(1*3)=86
86 % 10 = 6
So 123227-23-6 is a valid CAS Registry Number.

123227-23-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name 11-[2-[(2-methoxybenzoyl)amino]ethylsulfanyl]-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylic acid

1.2 Other means of identification

Product number -
Other names 11-((2-((2-Methoxybenzoyl)amino)ethyl)thio)-6,11-dihydro-dibenz(b,e)oxepin-2-carboxylic acid

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:123227-23-6 SDS

123227-23-6Downstream Products

123227-23-6Relevant articles and documents

Non-prostanoid thromboxane A2 receptor antagonists with a dibenzoxepin ring system. 1

Ohshima,Takami,Sato,Obase,Miki,Ishii,Karasawa,Kubo

, p. 3394 - 3402 (2007/10/02)

A series of 11-[[2-[(arylsulfonyl)amino]ethyl]thio]-6,11- dihydrodibenz[b,e]oxepin-2-carboxylic acids and related derivatives were synthesized. The compounds were tested for their antagonizing effects on guinea pig platelet TXA2/PGH2 receptors. Structure-activity relationships are discussed. (±)-11-[[2-[(Styrylsulfonyl)amino]ethyl]thio]-6,11- dihydrodibenz[b,e]oxepin-2-carboxylic acid (41) and (±)-11-[[2- [(phenylsulfonyl)amino]ethyl]thio]-6,11-dihydrodibenz[b,e]thiepin-2- carboxylic acid (4af) were the most promising compounds with K(i) values of 6.5 ± 0.29 and 3.7 ± 0.31 nM, respectively, for the TXA2/PGH2 receptor. These compounds also significantly inhibited U-46619-induced guinea pig platelet aggregation ex vivo (10 mg/kg po). Compound 41 was resolved into its optically active form. The (-)-isomer was 60-fold more potent than the (+)- isomer in the TXA2/PGH2 receptor binding assay. Some compounds tested in this study showed both TXA2/PGH2 receptor antagonizing and TXA2 synthase inhibitory effects.

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