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Bentamapimod

Also known as 2-(1,3-benzothiazol-2-yl)-2-[2-({4-[(morpholin-4-yl)methyl]phenyl}methoxy)pyrimidin-4-yl]acetonitrile, 2-(1,3-Benzothiazol-2-yl)-2-(2-((4-((morpholin-4-yl)methyl)phenyl)methoxy)pyrimidin-4-yl)acetonitrile, bentamapimodum

Bentamapimod chemical structure, C25H23N5O2S, CAS 848344-36-5
2D chemical structure

Key facts

What buyers check first

CAS number
848344-36-5
Formula
C25H23N5O2S
Molar mass
457.56 g/mol
EC number
805-471-3
HS code
293420
Category
Screening compounds

What is Bentamapimod?

Plain description, key identifiers and synonyms

Bentamapimod is a chemical substance with the molecular formula C25H23N5O2S and a molar mass of 457.56 g/mol. Its CAS registry number is 848344-36-5. The IUPAC name is 2-(1,3-benzothiazol-2-yl)-2-[2-[[4-(morpholin-4-ylmethyl)phenyl]methoxy]pyrimidin-4-yl]acetonitrile.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
2-(1,3-benzothiazol-2-yl)-2-[2-[[4-(morpholin-4-ylmethyl)phenyl]methoxy]pyrimidin-4-yl]acetonitrile
CAS number
848344-36-5 CAS number cross-checkedOther or deprecated CAS: 541507-14-6
EC number
805-471-3
Molecular formula
C25H23N5O2S
UNII
TT3L4B4U0N
MDL number
MFCD08272350
InChIKey
XCPPIJCBCWUBNT-UHFFFAOYSA-N
InChI
InChI=1S/C25H23N5O2S/c26-15-20(24-28-22-3-1-2-4-23(22)33-24)21-9-10-27-25(29-21)32-17-19-7-5-18(6-8-19)16-30-11-13-31-14-12-30/h1-10,20H,11-14,16-17H2
SMILES (canonical and isomeric)
C1COCCN1CC2=CC=C(C=C2)COC3=NC=CC(=N3)C(C#N)C4=NC5=CC=CC=C5S4

Synonyms

  • 2-(1,3-benzothiazol-2-yl)-2-[2-({4-[(morpholin-4-yl)methyl]phenyl}methoxy)pyrimidin-4-yl]acetonitrile
  • 2-(1,3-Benzothiazol-2-yl)-2-(2-((4-((morpholin-4-yl)methyl)phenyl)methoxy)pyrimidin-4-yl)acetonitrile
  • bentamapimodum
  • AS 602801
  • Bentamapimod (Tautomer)
  • 2-(Benzo[d]thiazol-2-yl)-2-(2-((4-(morpholinomethyl)benzyl)oxy)pyrimidin-4-yl)acetonitrile
  • 2-(1,3-benzothiazol-2-yl)-2-[2-[[4-(morpholin-4-ylmethyl)phenyl]methoxy]pyrimidin-4-yl]acetonitrile
  • (1,3-Benzothiazol-2-yl)[2-[[4-[(morpholin-4-yl)methyl]benzyl]oxy]pyrimidin-4-yl]acetonitrile
  • AS 602801(Bentamapimod)
  • Bentamapimod (AS602801)
  • AS 602801(Bentamapimod)?
  • 2-(2-Benzothiazolyl)-2-[2-[[4-(morpholinomethyl)benzyl]oxy]-4-pyrimidinyl]acetonitrile
  • 2-(benzo[d]thiazol-2-yl)-2-(2-(4-(morpholinomethyl)benzyloxy)pyrimidin-4-yl)acetonitrile
  • (1,3-Benzothiazol-2-yl)[2-({4-[(morpholin-4-yl)methyl]phenyl}methoxy)pyrimidin-4-yl]acetonitrile
  • 2-(1,3-benzothiazol-2-yl)-2-[2-[[4-(morpholinomethyl)phenyl]methoxy]pyrimidin-4-yl]acetonitrile

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
457.56 g/molcalc.
Exact mass
457.1572 Dacalc.
LogP (octanol/water)
4.15calc.
Topological polar surface area
84.16 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
7calc.
Heavy atoms
33calc.
Rings
5calc.
Aromatic rings
4calc.
Fraction sp3 carbons
0.28calc.
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, c1ccc2sc(Cc3ccnc(OCc4ccc(CN5CCOCC5)cc4)n3)nc2c1

c1ccc2sc(Cc3ccnc(OCc4ccc(CN5CCOCC5)cc4)n3)nc2c1

5 rings, 31 atoms.

1 other chemical share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H302 + H332Harmful if swallowed. Harmful if inhaled.
  • H302Harmful if swallowed.
  • H315Causes skin irritation.
  • H332Harmful if inhaled.
Precautionary statements (14)
  • P261Avoid breathing dust, fume, gas, mist, vapours or spray.
  • P264Wash skin thoroughly after handling.
  • P270Do not eat, drink or smoke when using this product.
  • P271Use only outdoors or in a well-ventilated area.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P301 + P317If swallowed: Get medical help.
  • P302 + P352If on skin: Wash with plenty of water.
  • P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
  • P317Get medical help.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P330Rinse mouth.
  • P332 + P317If skin irritation occurs: Get medical help.
  • P362 + P364Take off contaminated clothing. And wash it before reuse.
  • P501Dispose of contents and container in accordance with local regulations.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Full safety data and first aid

Bentamapimod suppliers

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Bentamapimod 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 Bentamapimod is traded under.

HS 2934.20Indicative HS code

Compounds containing in the structure a benzothiazole ring-system (whether or not…

World exports in 2024
$662M
+4.3% vs 2023, imports $630M
2019 to 2024
Top exporters
  1. China62.9%
  2. Belgium14.6%
  3. United States5.4%
Top importers
  1. India * partner reported18.5%
  2. United States18.1%
  3. Brazil6.7%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Bentamapimod?

Bentamapimod is a chemical substance with the molecular formula C25H23N5O2S and a molar mass of 457.56 g/mol. Its CAS registry number is 848344-36-5. The IUPAC name is 2-(1,3-benzothiazol-2-yl)-2-[2-[[4-(morpholin-4-ylmethyl)phenyl]methoxy]pyrimidin-4-yl]acetonitrile.

What is the CAS number of Bentamapimod?

The CAS registry number of Bentamapimod is 848344-36-5. Other or deprecated CAS numbers: 541507-14-6.

What is the molecular formula and weight of Bentamapimod?

The molecular formula of Bentamapimod is C25H23N5O2S and its molar mass is 457.56 g/mol.

What is Bentamapimod used for?

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

Is Bentamapimod hazardous?

Bentamapimod carries the GHS signal word "Warning". Main hazards: harmful if swallowed. harmful if inhaled, harmful if swallowed, causes skin irritation. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Bentamapimod?

Bentamapimod is usually classified under HS code 293420 (Compounds containing in the structure a benzothiazole ring-system (whether or not…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Bentamapimod?

CompoundList lists 4 suppliers of Bentamapimod in China, Canada 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 Bentamapimod?

Suppliers quote Bentamapimod 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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