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Screening compounds

Dolasetron

Also known as 1H-Indole-3-carboxylic acid, octahydro-3-oxo-2,6-methano-2H-quinolizin-8-yl ester, stereoisomer, Anzemet Cinv, (5s,6R,8r,9aS)-3-Oxooctahydro-2H-2,6-methanoquinolizin-8-yl 1H-indole-3-carboxylate

CAS 115956-12-2Formula C19H20N2O3Molar mass 324.38 g/mol
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Dolasetron chemical structure, C19H20N2O3, CAS 115956-12-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
115956-12-2
Formula
C19H20N2O3
Molar mass
324.38 g/mol
HS code
293399
Category
Screening compounds

What is Dolasetron?

Plain description, key identifiers and synonyms

LSM-5418 is an indolyl carboxylic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(3S,7R)-10-oxo-8-azatricyclo[5.3.1.03,8]undecan-5-yl] 1H-indole-3-carboxylate
CAS number
115956-12-2 CAS number cross-checkedOther or deprecated CAS: 115956-13-3
Molecular formula
C19H20N2O3
UNII
82WI2L7Q6E
MDL number
MFCD00865542
InChIKey
UKTAZPQNNNJVKR-AKJUYKBHSA-N
InChI
InChI=1S/C19H20N2O3/c22-18-10-21-12-5-11(18)6-13(21)8-14(7-12)24-19(23)16-9-20-17-4-2-1-3-15(16)17/h1-4,9,11-14,20H,5-8,10H2/t11?,12-,13+,14?
Canonical SMILES
O=C(OC1CC2CC3CC(C1)N2CC3=O)c1c[nH]c2ccccc12
Isomeric SMILES
C1[C@@H]2CC(C[C@H]3N2CC(=O)C1C3)OC(=O)C4=CNC5=CC=CC=C54

Synonyms

  • 1H-Indole-3-carboxylic acid, octahydro-3-oxo-2,6-methano-2H-quinolizin-8-yl ester, stereoisomer
  • Anzemet Cinv
  • (5s,6R,8r,9aS)-3-Oxooctahydro-2H-2,6-methanoquinolizin-8-yl 1H-indole-3-carboxylate
  • rel-(5s,6R,8r,9aS)-3-Oxooctahydro-1H-2,6-methanoquinolizin-8-yl 1H-indole-3-carboxylate
  • 1H-Indole-3-carboxylic acid, octahydro-3-oxo-2,6-methano-2H-quinolizin-8-yl ester, (2alpha,6alpha,8alpha,9a.beta.)-
  • [(3S,7R)-10-oxo-8-azatricyclo[5.3.1.03,8]undecan-5-yl] 1H-indole-3-carboxylate
  • (1s,3R,5s,7S)-10-oxo-8-azatricyclo[5.3.1.0(3),?]undecan-5-yl 1H-indole-3-carboxylate
  • Octahydro-3-oxo-2,6-methano-2H-quinolizin-8-yl ester
  • (6R)-3-oxooctahydro-1H-2,6-methanoquinolizin-8-yl 1H-indole-3-carboxylate
  • (1s,3R,5r,7S)-10-oxo-8-azatricyclo[5.3.1.0,3,8]undecan-5-yl 1H-indole-3-carboxylate
  • (2R,6R,8R,9aS)-3-oxooctahydro-2H-2,6-methanoquinolizin-8-yl 1H-indole-3-carboxylate
  • (3R,5r,7S)-10-oxo-8-azatricyclo[5.3.1.0?,?]undecan-5-yl 1H-indole-3-carboxylate
  • (5s,6R,8r,9aS)-3-Oxooctahydro-1H-2,6-methanoquinolizin-8-yl 1H-indole-3-carboxylate
  • (2,6,8,9a)-octahydro-3-oxo-2,6-methano-2H-quinolizin-8-yl-1Hindole-3-carboxylate monomethanesulfonate, monohydrate
  • indole-3-carboxylic acid, ester with (8R)-hexahydro-8-hydroxy-2,6-methano-2H-quinolizin-3(4H)-one

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
324.38 g/molcalc.
Exact mass
324.1474 Dacalc.
LogP (octanol/water)
2.52calc.
Topological polar surface area
62.4 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
2calc.
Heavy atoms
24calc.
Rings
6calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.47calc.
Formal charge
0calc.
Stereocentres
5calc.
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, O=C(OC1CC2CC3CC(C1)N2CC3=O)c1c[nH]c2ccccc12

O=C(OC1CC2CC3CC(C1)N2CC3=O)c1c[nH]c2ccccc12

6 rings, 24 atoms, the Anzemet ring system.

7 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.

Dolasetron suppliers

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

All 4 suppliers
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Where suppliers are based

4 suppliers in 3 countries

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Dolasetron 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

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

Frequently asked questions

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

What is Dolasetron?

LSM-5418 is an indolyl carboxylic acid.

What is the CAS number of Dolasetron?

The CAS registry number of Dolasetron is 115956-12-2. Other or deprecated CAS numbers: 115956-13-3.

What is the molecular formula and weight of Dolasetron?

The molecular formula of Dolasetron is C19H20N2O3 and its molar mass is 324.38 g/mol.

What is Dolasetron used for?

Known uses and roles of Dolasetron include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Dolasetron hazardous?

No GHS hazard classification for Dolasetron 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 Dolasetron?

Dolasetron 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 Dolasetron?

CompoundList lists 4 suppliers of Dolasetron in India, China and United States. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

Where can I buy Dolasetron in India?

2 suppliers in India list Dolasetron on CompoundList. Filter the suppliers list by country and send a request to compare prices, grades and delivery times.

What is the price of Dolasetron?

Suppliers quote Dolasetron 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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