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Screening compounds

Azd-1981

Also known as AZD 1981, 2-[4-acetamido-3-(4-chlorophenyl)sulfanyl-2-methylindol-1-yl]acetic acid, 1H-Indole-1-acetic acid, 4-(acetylamino)-3-((4-chlorophenyl)thio)-2-methyl-

CAS 802904-66-1Formula C19H17ClN2O3SMolar mass 388.88 g/mol
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Azd-1981 chemical structure, C19H17ClN2O3S, CAS 802904-66-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
802904-66-1
Formula
C19H17ClN2O3S
Molar mass
388.88 g/mol
HS code
293399
Category
Screening compounds

What is Azd-1981?

Plain description, key identifiers and synonyms

Azd-1981 is a chemical substance with the molecular formula C19H17ClN2O3S and a molar mass of 388.88 g/mol. Its CAS registry number is 802904-66-1. The IUPAC name is 2-[4-acetamido-3-(4-chlorophenyl)sulfanyl-2-methylindol-1-yl]acetic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
2-[4-acetamido-3-(4-chlorophenyl)sulfanyl-2-methylindol-1-yl]acetic acid
CAS number
802904-66-1 CAS number cross-checked
Molecular formula
C19H17ClN2O3S
UNII
2AD53WQ2CX
MDL number
MFCD26936340
InChIKey
JWYIGNODXSRKGP-UHFFFAOYSA-N
InChI
InChI=1S/C19H17ClN2O3S/c1-11-19(26-14-8-6-13(20)7-9-14)18-15(21-12(2)23)4-3-5-16(18)22(11)10-17(24)25/h3-9H,10H2,1-2H3,(H,21,23)(H,24,25)
SMILES (canonical and isomeric)
CC1=C(C2=C(C=CC=C2N1CC(=O)O)NC(=O)C)SC3=CC=C(C=C3)Cl

Synonyms

  • AZD 1981
  • 2-[4-acetamido-3-(4-chlorophenyl)sulfanyl-2-methylindol-1-yl]acetic acid
  • 1H-Indole-1-acetic acid, 4-(acetylamino)-3-((4-chlorophenyl)thio)-2-methyl-
  • 2-{3-[(4-chlorophenyl)sulfanyl]-4-acetamido-2-methyl-1H-indol-1-yl}acetic acid
  • 2-(4-acetamido-3-(4-chlorophenyl)sulfanyl-2-methylindol-1-yl)acetic acid
  • 2-(3-((4-chlorophenyl)sulfanyl)-4-acetamido-2-methyl-1H-indol-1-yl)acetic acid
  • 2-(4-Acetamido-3-((4-chlorophenyl)thio)-2-methyl-1H-indol-1-yl)acetic acid
  • 7-Methyl-5-[(3-piperazin-1-ylMethyl)-1,2,4-oxadiazol-5-yl-]-2-[4-(trifluoroMethoxy)benzyl]-2,3-dihydro-1H-isoindol-1-one Methanesulphonate
  • 4-(Acetylamino)-3-((4-chlorophenyl)thio)-2-methyl-1H-indole-1-acetic acid
  • 4-(acetylamino)-3-[(4-chlorophenyl)thio]-2-methyl-1h-indole-1-acetic acid
  • AZD1981?
  • 2-[4-acetamido-3-(4-chlorophenyl)sulfanyl-2-methyl-indol-1-yl]acetic Acid
  • 2-(4-acetamido-3-(4-chlorophenylthio)-2-methyl-1H-indol-1-yl)acetic acid
  • 2-[4-Acetamido-3-[(4-chlorophenyl)thio]-2-methyl-1-indolyl]acetic Acid
  • [4-acetylamino-3-(4-chlorophenylsulfanyl)-2-methyl-1H-indol-1-yl]acetic acid
  • N-[(1S)-2-(Dimethylamino)-1-phenylethyl]-6,6-dimethyl-3-[(2-methylthieno[3,2-d]pyrimidin-4-yl)amino]-4,6-dihydropyrrolo[3,4-c]pyrazo le-5(1H)-carboxamide

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
388.88 g/molcalc.
Exact mass
388.0648 Dacalc.
LogP (octanol/water)
4.8calc.
Topological polar surface area
71.33 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
5calc.
Heavy atoms
26calc.
Rings
3calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.16calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (0 violations)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, c1ccc(Sc2c[nH]c3ccccc23)cc1

c1ccc(Sc2c[nH]c3ccccc23)cc1

3 rings, 16 atoms, the 3-Phenylthioindole ring system.

118 other chemicals 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.

Azd-1981 suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

All 2 suppliers
  • Axon Medchem
    United States, RestonUnclaimed profile
    Azd-1981Grade, purity and minimum order on request
    Price on request
    View
  • Sun-shine Chemical
    China, WuhanUnclaimed profile
    Azd-1981Grade, purity and minimum order on request
    Price on request
    View

Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.

Where suppliers are based

2 suppliers in 2 countries

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Azd-1981 price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Roles

  • anti-asthmatic agent

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 Azd-1981 is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

The HS code shown for Azd-1981 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Azd-1981, based on the data on this page

What is Azd-1981?

Azd-1981 is a chemical substance with the molecular formula C19H17ClN2O3S and a molar mass of 388.88 g/mol. Its CAS registry number is 802904-66-1. The IUPAC name is 2-[4-acetamido-3-(4-chlorophenyl)sulfanyl-2-methylindol-1-yl]acetic acid.

What is the CAS number of Azd-1981?

The CAS registry number of Azd-1981 is 802904-66-1.

What is the molecular formula and weight of Azd-1981?

The molecular formula of Azd-1981 is C19H17ClN2O3S and its molar mass is 388.88 g/mol.

What is Azd-1981 used for?

Known uses and roles of Azd-1981 include building blocks in research and laboratory, screening compounds in research and laboratory and anti-asthmatic agent.

Is Azd-1981 hazardous?

No GHS hazard classification for Azd-1981 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 Azd-1981?

Azd-1981 is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Azd-1981?

CompoundList lists 2 suppliers of Azd-1981 in China and United States. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Azd-1981?

Suppliers quote Azd-1981 on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

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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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