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Screening compounds

Abecarnil

Also known as Abecarnilum, abecarnilo, Isopropyl 6-benzyloxy-4-methoxymethyl-beta-carboline-3-carboxylate

CAS 111841-85-1Formula C24H24N2O4Molar mass 404.47 g/mol
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Abecarnil chemical structure, C24H24N2O4, CAS 111841-85-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
111841-85-1
Formula
C24H24N2O4
Molar mass
404.47 g/mol
HS code
293399
Category
Screening compounds

What is Abecarnil?

Plain description, key identifiers and synonyms

Abecarnil is a chemical substance with the molecular formula C24H24N2O4 and a molar mass of 404.47 g/mol. Its CAS registry number is 111841-85-1. The IUPAC name is propan-2-yl 4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
propan-2-yl 4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate
CAS number
111841-85-1 CAS number cross-checked
Molecular formula
C24H24N2O4
UNII
IZM1PNJ3JL
MDL number
MFCD00865327
InChIKey
RLFKILXOLJVUNF-UHFFFAOYSA-N
InChI
InChI=1S/C24H24N2O4/c1-15(2)30-24(27)23-19(14-28-3)22-18-11-17(29-13-16-7-5-4-6-8-16)9-10-20(18)26-21(22)12-25-23/h4-12,15,26H,13-14H2,1-3H3
SMILES (canonical and isomeric)
CC(C)OC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4

Synonyms

  • Abecarnilum
  • abecarnilo
  • Isopropyl 6-benzyloxy-4-methoxymethyl-beta-carboline-3-carboxylate
  • Isopropyl 6-(benzyloxy)-4-(methoxymethyl)-9H-pyrido(3,4-b)indole-3-carboxylate
  • isopropyl 6-(benzyloxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate
  • ZK 112119
  • propan-2-yl 4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate
  • Abecarnil (INN)
  • PDSP1_001755
  • PDSP1_001775
  • PDSP2_001738
  • PDSP2_001758
  • 6-benzyloxy-4-methoxymethyl-beta-carboline-3-carboxylic acid isopropyl ester
  • Propan-2-yl 6-(benzyloxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate
  • 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(methoxymethyl)-6-(phenylmethoxy)-, 1-methylethyl ester
  • 6-Benzyloxy-4-methoxymethyl-9H-beta-carboline-3-carboxylic acid isopropyl ester
  • 6-Benzyloxy-4-methoxymethyl-9H-beta-carboline-3-carboxylic acid isopropyl ester(Abecarnil)
  • 6-benzyloxy-4-methoxymethyl-9H-pyrido[3,4-b]indole-3-carboxylic acid-1-methylethyl-ester
  • isopropyl 6-benzyloxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate
  • 6-benzyloxy-4-methoxymethyl-9H-pyrido[3,4-b]indole-3-carboxylic acid-(1-methyl-ethyl)-ester
  • 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 4-(methoxymethyl)-6-(phenylmethoxy)-, 1-methylethyl ester

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
404.47 g/molcalc.
Exact mass
404.1736 Dacalc.
LogP (octanol/water)
5.01calc.
Topological polar surface area
73.44 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
7calc.
Heavy atoms
30calc.
Rings
4calc.
Aromatic rings
4calc.
Fraction sp3 carbons
0.25calc.
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, c1ccc(COc2ccc3[nH]c4cnccc4c3c2)cc1

c1ccc(COc2ccc3[nH]c4cnccc4c3c2)cc1

4 rings, 21 atoms.

2 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.

Abecarnil 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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Abecarnil price

Indicative price range per kg from live supplier offers

No published prices right now

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Uses and applications

What the substance is used for, by industry and function

Pharmacological actions

  • Anti-Anxiety Agents
  • Anticonvulsants

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 Abecarnil 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 Abecarnil is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

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

What is Abecarnil?

Abecarnil is a chemical substance with the molecular formula C24H24N2O4 and a molar mass of 404.47 g/mol. Its CAS registry number is 111841-85-1. The IUPAC name is propan-2-yl 4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate.

What is the CAS number of Abecarnil?

The CAS registry number of Abecarnil is 111841-85-1.

What is the molecular formula and weight of Abecarnil?

The molecular formula of Abecarnil is C24H24N2O4 and its molar mass is 404.47 g/mol.

What is Abecarnil used for?

Known uses and roles of Abecarnil include building blocks in research and laboratory, screening compounds in research and laboratory, anti-anxiety agents and anticonvulsants.

Is Abecarnil hazardous?

No GHS hazard classification for Abecarnil 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 Abecarnil?

Abecarnil 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 Abecarnil?

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

What is the price of Abecarnil?

Suppliers quote Abecarnil 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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