CompoundList

Arotinolol

Also known as Arotinololum, 5-(2-{[3-(tert-butylamino)-2-hydroxypropyl]sulfanyl}-1,3-thiazol-4-yl)thiophene-2-carboxamide, 5-(2-((3-(tert-butylamino)-2-hydroxypropyl)sulfanyl)-1,3-thiazol-4-yl)thiophene-2-carboxamide

CAS 68377-92-4Formula C15H21N3O2S3Molar mass 371.55 g/mol
Arotinolol chemical structure, C15H21N3O2S3, CAS 68377-92-4
2D chemical structure

Key facts

What buyers check first

CAS number
68377-92-4
Formula
C15H21N3O2S3
Molar mass
371.55 g/mol
HS code
293410
Category
Screening compounds

What is Arotinolol?

Plain description, key identifiers and synonyms

Arotinolol is a member of thiophenes and an aromatic amide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
5-[2-[3-(tert-butylamino)-2-hydroxypropyl]sulfanyl-1,3-thiazol-4-yl]thiophene-2-carboxamide
CAS number
68377-92-4 CAS number cross-checkedOther or deprecated CAS: 52560-77-7
Molecular formula
C15H21N3O2S3
UNII
394E3P3B99
MDL number
MFCD00865895
InChIKey
BHIAIPWSVYSKJS-UHFFFAOYSA-N
InChI
InChI=1S/C15H21N3O2S3/c1-15(2,3)17-6-9(19)7-21-14-18-10(8-22-14)11-4-5-12(23-11)13(16)20/h4-5,8-9,17,19H,6-7H2,1-3H3,(H2,16,20)
SMILES (canonical and isomeric)
CC(C)(C)NCC(CSC1=NC(=CS1)C2=CC=C(S2)C(=O)N)O

Synonyms

  • Arotinololum
  • 5-(2-{[3-(tert-butylamino)-2-hydroxypropyl]sulfanyl}-1,3-thiazol-4-yl)thiophene-2-carboxamide
  • 5-(2-((3-(tert-butylamino)-2-hydroxypropyl)sulfanyl)-1,3-thiazol-4-yl)thiophene-2-carboxamide
  • 2-(3'-tert-Butylamino-2'-hydroxypropylthio)-4-(5'-carbamoyl-2'-thienyl)thiazole hydrochloride
  • 5-(2-((3-((1,1-Dimethylethyl)amino)-2-hydroxypropyl)thio)-4-thiazolyl)-2-thiophenecarboxamide
  • 5-(2-((3-(tert-Butylamino)-2-hydroxypropyl)thio)thiazol-4-yl)thiophene-2-carboxamide
  • (+-)-Arotinolol
  • 5-[2-[3-(tert-butylamino)-2-hydroxypropyl]sulfanyl-1,3-thiazol-4-yl]thiophene-2-carboxamide
  • 2-(3-tert-Butylamino-2-hydroxypropylthio)-4-(5-carbamoyl-2-thienyl)thiazole
  • Arotinolol (INN)
  • 2-Thiophenecarboxamide,5-[2-[[3-[(1,1-dimethylethyl)amino]-2-hydroxypropyl]thio]-4-thiazolyl]-
  • (+-)-5-(2-((3-(tert-Butylamino)-2-hydroxypropyl)thio)-4-thiazolyl)-2-thiophenecarboxamide
  • 2-Thiophenecarboxamide, 5-(2-((3-((1,1-dimethylethyl)amino)-2-hydroxypropyl)thio)-4-thiazolyl)-
  • Arotinolol free base
  • 68377-92-4 (free base)
  • 5-(2-((3-(tert-Butylamino)-2-hydroxypropyl)thio)-4-thiazolyl)-2-thiophenecarboxamide
  • (+/-)-5-(2-((3-(Tert-butylamino)-2-hydroxypropyl)thio)-4-thiazolyl)-2-thiophenecarboxamide
  • 5-(2-{[3-(tert-butylamino)-2-hydroxypropyl]sulfanyl}-1,3-thiazol-4-yl)-2-thiophenecarboxamide
  • 5-[2-({3-[(1,1-dimethylethyl)amino]-2-hydroxypropyl}thio)-1,3-thiazol-4-yl]thiophene-2-carboxamide
  • 5-[2-[3-(tert-butylamino)-2-oxidanyl-propyl]sulfanyl-1,3-thiazol-4-yl]thiophene-2-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
371.55 g/molcalc.
Exact mass
371.0796 Dacalc.
LogP (octanol/water)
2.81calc.
Topological polar surface area
88.24 ร…ยฒcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
7calc.
Rotatable bonds
7calc.
Heavy atoms
23calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.47calc.
Formal charge
0calc.
Stereocentres
1calc.
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, c1csc(-c2cscn2)c1

c1csc(-c2cscn2)c1

2 rings, 10 atoms.

165 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.

Arotinolol suppliers

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All 3 suppliers

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Where suppliers are based

3 suppliers in 1 country

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Arotinolol price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

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Uses and applications

What the substance is used for, by industry and function

Pharmacological actions

  • Adrenergic alpha-Antagonists
  • Adrenergic beta-Antagonists

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 Arotinolol is traded under.

HS 2934.10Indicative HS code

Compounds containing an unfused thiazole ring (whether or not hydrogenated) in theโ€ฆ

World exports in 2024
$3.88B
โˆ’16.1% vs 2023, imports $3.12B
2019 to 2024
Top exporters
  1. Switzerland * partner reported36.4%
  2. Ireland28.8%
  3. China10.0%
Top importers
  1. Canada33.4%
  2. United States14.4%
  3. Ireland13.1%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Arotinolol, based on the data on this page

What is Arotinolol?

Arotinolol is a member of thiophenes and an aromatic amide.

What is the CAS number of Arotinolol?

The CAS registry number of Arotinolol is 68377-92-4. Other or deprecated CAS numbers: 52560-77-7.

What is the molecular formula and weight of Arotinolol?

The molecular formula of Arotinolol is C15H21N3O2S3 and its molar mass is 371.55 g/mol.

What is Arotinolol used for?

Known uses and roles of Arotinolol include building blocks in research and laboratory, screening compounds in research and laboratory, adrenergic alpha-antagonists and adrenergic beta-antagonists.

Is Arotinolol hazardous?

No GHS hazard classification for Arotinolol 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 Arotinolol?

Arotinolol is usually classified under HS code 293410 (Compounds containing an unfused thiazole ring (whether or not hydrogenated) in theโ€ฆ). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Arotinolol?

CompoundList lists 3 suppliers of Arotinolol in China. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Arotinolol?

Suppliers quote Arotinolol 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

Practical guides that help when you source, ship or handle Arotinolol

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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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