3-(1-Azepanylsulfonyl)-N-(3-nitrophenyl)benzamide

Basic Information

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CAS Number

330461-64-8

Molecular Formula

C19H21N3O5S

Molecular Weight

403.45 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Solubility

Insuluble (1.0E-3 g/L) (25 ºC),

SMILES

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[O-][N+](=O)c1cccc(NC(=O)c2cccc(c2)S(=O)(=O)N3CCCCCC3)c1

InChI

InChI=1S/C19H21N3O5S/c23-19(20-16-8-6-9-17(14-16)22(24)25)15-7-5-10-18(13-15)28(26,27)21-11-3-1-2-4-12-21/h5-10,13-14H,1-4,11-12H2,(H,20,23)

InChIKey

HAYBKCHPEBZNGW-UHFFFAOYSA-N

Complexity

650

Synonyms & References

English

(S)-2-(2,2-DIMETHYL-1,3-DIOXOLAN-4-YL)ACETALDEHYDE
3-(azepane-1-sulfonyl)-N-(3-nitro-phenyl)-benzamide
AK-1
SIRT2 Inhibitor II, AK-1
3-[(Hexahydro-1H-azepin-1-yl)sulfonyl]-N-(3-nitrophenyl)-benzamide
SIRT2 Inhibitor II
3-(azepan-1-ylsulfonyl)-N-(3-nitrophenyl)benzamide
C19H21N3O5S
Oprea1_800498
Oprea1_861847
BCP09326
BDBM50346541
Y1899
A14370
3-(1-azepanylsulfonyl)-N-(3-nitrophenyl)benzamide

MDL Number

MFCD01122550

FAQ

What regulatory guidelines apply to 3-(1-Azepanylsulfonyl)-N-(3-nitrophenyl)benzamide (CAS: 330461-64-8)?

This compound must comply with GHS classification standards, which include health, environmental, and physical hazard categories. It is also subject to REACH regulations in the EU, requiring registration, evaluation, authorization, and restriction of chemicals. FDA and EPA may also have specific requirements for the handling, storage, and disposal of this compound in pharmaceutical and industrial applications.

Are there alternatives to 3-(1-Azepanylsulfonyl)-N-(3-nitrophenyl)benzamide (CAS: 330461-64-8) in synthesis?

Alternative reagents such as 3-(2-Azepanylsulfonyl)-N-(3-nitrophenyl)benzamide or 3-(1-Benzazepin-1-ylsulfonyl)-N-(3-nitrophenyl)benzamide can be considered. These compounds may offer similar functional groups but with different substituents, providing alternative pathways for synthesis.

What is the market or research trend for 3-(1-Azepanylsulfonyl)-N-(3-nitrophenyl)benzamide (CAS: 330461-64-8)?

There is growing research interest in this compound due to its potential applications in drug discovery, particularly in the development of new therapeutic agents. Market trends show increasing demand in pharmaceutical research, with a focus on its biological activity and mechanism of action.

How should waste containing 3-(1-Azepanylsulfonyl)-N-(3-nitrophenyl)benzamide (CAS: 330461-64-8) be handled?

Waste containing this compound should be collected in appropriate, leak-proof containers. It should be stored in a secure, well-ventilated area away from ignition sources and incompatible materials. For disposal, contact a professional hazardous waste management service to ensure compliance with local, national, and international regulations. Proper incineration or chemical neutralization methods should be employed.