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Central nervous system drugs

Roxindole

Also known as roxindol, roxindolum, 3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-indol-5-ol

CAS 112192-04-8Formula C23H26N2OMolar mass 346.47 g/mol
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Roxindole chemical structure, C23H26N2O, CAS 112192-04-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
112192-04-8
Formula
C23H26N2O
Molar mass
346.47 g/mol
HS code
293339
Category
Central nervous system drugs

What is Roxindole?

Plain description, key identifiers and synonyms

Roxindole is a member of indoles. It has a role as an alpha-adrenergic antagonist and a serotonergic drug.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-indol-5-ol
CAS number
112192-04-8 CAS number cross-checked
Molecular formula
C23H26N2O
UNII
43227SMS0O
InChIKey
HGEYJZMMUGWEOT-UHFFFAOYSA-N
InChI
InChI=1S/C23H26N2O/c26-21-9-10-23-22(16-21)20(17-24-23)8-4-5-13-25-14-11-19(12-15-25)18-6-2-1-3-7-18/h1-3,6-7,9-11,16-17,24,26H,4-5,8,12-15H2
SMILES (canonical and isomeric)
C1CN(CC=C1C2=CC=CC=C2)CCCCC3=CNC4=C3C=C(C=C4)O

Synonyms

  • roxindol
  • roxindolum
  • 3-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-indol-5-ol
  • 3-(4-(3,6-Dihydro-4-phenyl-1(2H)-pyridinyl)butyl)-1H-indol-5-ol
  • 3-[4-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)butyl]-1H-indol-5-ol
  • 3-(4-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)butyl)-1H-indol-5-ol
  • 3-(4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl)-1H-indol-5-ol
  • 1H-Indol-5-ol, 3-(4-(3,6-dihydro-4-phenyl-1(2H)-pyridinyl)butyl)-
  • 3-(4-(4-phenyl-5,6-dihydropyridin-1(2H)-yl)butyl)-1H-indol-5-ol
  • 3-(4-(3,6-Dihydro-4-phenyl-1(2H)-pyridylbutyl)indol-5-ol
  • Tocris-1559
  • PDSP1_001392
  • PDSP2_001376

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
346.47 g/molcalc.
Exact mass
346.2045 Dacalc.
LogP (octanol/water)
4.99calc.
Topological polar surface area
39.26 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
6calc.
Heavy atoms
26calc.
Rings
4calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.3calc.
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, C1=C(c2ccccc2)CCN(CCCCc2c[nH]c3ccccc23)C1

C1=C(c2ccccc2)CCN(CCCCc2c[nH]c3ccccc23)C1

4 rings, 25 atoms, the 3-[4-(4-Phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1H-indole ring system.

6 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.

Roxindole suppliers

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

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Roxindole 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

Industries and functions

Pharmacological actions

  • Antidepressive Agents
  • Dopamine Agonists

Roles

  • adrenergic agent
  • adrenergic antagonist
  • alpha-adrenergic antagonist
  • alpha-adrenergic drug
  • neurotransmitter agent
  • pharmaceutical
  • serotonergic drug

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 Roxindole is traded under.

HS 2933.39Indicative HS code

Heterocyclic compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure…

World exports in 2024
$9.16B
−17.9% vs 2023, imports $10.6B
2019 to 2024
Top exporters
  1. China21.5%
  2. India * partner reported12.3%
  3. Ireland11.6%
Top importers
  1. Germany14.2%
  2. United States12.8%
  3. Brazil10.1%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Roxindole?

Roxindole is a member of indoles. It has a role as an alpha-adrenergic antagonist and a serotonergic drug.

What is the CAS number of Roxindole?

The CAS registry number of Roxindole is 112192-04-8.

What is the molecular formula and weight of Roxindole?

The molecular formula of Roxindole is C23H26N2O and its molar mass is 346.47 g/mol.

What is Roxindole used for?

Known uses and roles of Roxindole include cns agents in pharmaceuticals, adrenergic agent, adrenergic antagonist, alpha-adrenergic antagonist, alpha-adrenergic drug and 5 more.

Is Roxindole hazardous?

No GHS hazard classification for Roxindole 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 Roxindole?

Roxindole is usually classified under HS code 293339 (Compounds containing an unfused pyridine ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Roxindole?

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

What is the price of Roxindole?

Suppliers quote Roxindole 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 Roxindole

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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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