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Screening compounds

AR-C69457AA

Also known as 2(3H)-Benzothiazolone, 4-hydroxy-7-(2-((3-((2-(2-(1-naphthalenyl)ethoxy)ethyl)sulfonyl)propyl)amino)ethyl)-, 4-Hydroxy-7-(2-(3-(2-(2-(1-naphthyl)ethoxy)ethylsulfonyl)propylamino)ethyl)-3H-1,3-benzothiazol-2-one, 7-(2-((3-(2-(2-(Naphthalen-1-yl)ethoxy)ethanesulfonyl)propyl)amino)ethyl)-1,3-benzothiazole-2,4-diol

CAS 438576-82-0Formula C26H30N2O5S2Molar mass 514.67 g/mol
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AR-C69457AA chemical structure, C26H30N2O5S2, CAS 438576-82-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
438576-82-0
Formula
C26H30N2O5S2
Molar mass
514.67 g/mol
HS code
293420
Category
Screening compounds

What is AR-C69457AA?

Plain description, key identifiers and synonyms

AR-C69457AA is a chemical substance with the molecular formula C26H30N2O5S2 and a molar mass of 514.67 g/mol. Its CAS registry number is 438576-82-0. The IUPAC name is 4-hydroxy-7-[2-[3-[2-(2-naphthalen-1-ylethoxy)ethylsulfonyl]propylamino]ethyl]-3H-1,3-benzothiazol-2-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4-hydroxy-7-[2-[3-[2-(2-naphthalen-1-ylethoxy)ethylsulfonyl]propylamino]ethyl]-3H-1,3-benzothiazol-2-one
CAS number
438576-82-0
Molecular formula
C26H30N2O5S2
UNII
W385HS2JPV
InChIKey
AAZOUMYVCNRDMB-UHFFFAOYSA-N
InChI
InChI=1S/C26H30N2O5S2/c29-23-10-9-21(25-24(23)28-26(30)34-25)11-14-27-13-4-17-35(31,32)18-16-33-15-12-20-7-3-6-19-5-1-2-8-22(19)20/h1-3,5-10,27,29H,4,11-18H2,(H,28,30)
SMILES (canonical and isomeric)
C1=CC=C2C(=C1)C=CC=C2CCOCCS(=O)(=O)CCCNCCC3=C4C(=C(C=C3)O)NC(=O)S4

Synonyms

  • 2(3H)-Benzothiazolone, 4-hydroxy-7-(2-((3-((2-(2-(1-naphthalenyl)ethoxy)ethyl)sulfonyl)propyl)amino)ethyl)-
  • 4-Hydroxy-7-(2-(3-(2-(2-(1-naphthyl)ethoxy)ethylsulfonyl)propylamino)ethyl)-3H-1,3-benzothiazol-2-one
  • 7-(2-((3-(2-(2-(Naphthalen-1-yl)ethoxy)ethanesulfonyl)propyl)amino)ethyl)-1,3-benzothiazole-2,4-diol
  • 2(3H)-Benzothiazolone, 4-hydroxy-7-[2-[[3-[[2-[2-(1-naphthalenyl)ethoxy]ethyl]sulfonyl]propyl]amino]ethyl]-

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
514.67 g/molcalc.
Exact mass
514.1596 Dacalc.
LogP (octanol/water)
3.64calc.
Topological polar surface area
108.5 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
7calc.
Rotatable bonds
13calc.
Heavy atoms
35calc.
Rings
4calc.
Aromatic rings
4calc.
Fraction sp3 carbons
0.35calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (1 violation)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=c1[nH]c2cccc(CCNCCCS(=O)(=O)CCOCCc3cccc4ccccc34)c2s1

O=c1[nH]c2cccc(CCNCCCS(=O)(=O)CCOCCc3cccc4ccccc34)c2s1

4 rings, 34 atoms.

1 other chemical share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

AR-C69457AA suppliers

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AR-C69457AA price

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code AR-C69457AA is traded under.

HS 2934.20Indicative HS code

Compounds containing in the structure a benzothiazole ring-system (whether or not…

World exports in 2024
$662M
+4.3% vs 2023, imports $630M
2019 to 2024
Top exporters
  1. China62.9%
  2. Belgium14.6%
  3. United States5.4%
Top importers
  1. India * partner reported18.5%
  2. United States18.1%
  3. Brazil6.7%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for AR-C69457AA is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about AR-C69457AA, based on the data on this page

What is AR-C69457AA?

AR-C69457AA is a chemical substance with the molecular formula C26H30N2O5S2 and a molar mass of 514.67 g/mol. Its CAS registry number is 438576-82-0. The IUPAC name is 4-hydroxy-7-[2-[3-[2-(2-naphthalen-1-ylethoxy)ethylsulfonyl]propylamino]ethyl]-3H-1,3-benzothiazol-2-one.

What is the CAS number of AR-C69457AA?

The CAS registry number of AR-C69457AA is 438576-82-0.

What is the molecular formula and weight of AR-C69457AA?

The molecular formula of AR-C69457AA is C26H30N2O5S2 and its molar mass is 514.67 g/mol.

What is AR-C69457AA used for?

Known uses and roles of AR-C69457AA include building blocks in research and laboratory and screening compounds in research and laboratory.

Is AR-C69457AA hazardous?

No GHS hazard classification for AR-C69457AA is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of AR-C69457AA?

AR-C69457AA is usually classified under HS code 293420 (Compounds containing in the structure a benzothiazole ring-system (whether or not…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy AR-C69457AA?

Post a free request on CompoundList and suppliers of AR-C69457AA will send you quotes. Your contact details stay private until you accept a quote.

What is the price of AR-C69457AA?

Suppliers quote AR-C69457AA on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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