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Screening compounds

Mk-0752

Also known as MK 0752, 3-[4-(4-chlorophenyl)sulfonyl-4-(2,5-difluorophenyl)cyclohexyl]propanoic Acid, Cyclohexanepropanoic acid, 4-((4-chlorophenyl)sulfonyl)-4-(2,5-difluorophenyl)-, cis-

CAS 471905-41-6Formula C21H21ClF2O4SMolar mass 442.91 g/molEC 684-251-7
GHS signal word: Danger. Pictograms: Corrosive, Harmful or irritant, Serious health hazard 9 suppliers listed
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Mk-0752 chemical structure, C21H21ClF2O4S, CAS 471905-41-6
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
471905-41-6
Formula
C21H21ClF2O4S
Molar mass
442.91 g/mol
EC number
684-251-7
HS code
293090
Category
Screening compounds

What is Mk-0752?

Plain description, key identifiers and synonyms

Notch Signaling Pathway Inhibitor MK0752 is a synthetic small molecule with potential antineoplastic activity. MK0752 inhibits the Notch signaling pathway, which may result in induction of growth arrest and apoptosis in tumor cells in which the Notch signaling pathway is overactivated. The Notch signaling pathway plays an important role in cell-fate determination, cell survival, and cell proliferation.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-[4-(4-chlorophenyl)sulfonyl-4-(2,5-difluorophenyl)cyclohexyl]propanoic acid
CAS number
471905-41-6Other or deprecated CAS: 952578-68-6
EC number
684-251-7
Molecular formula
C21H21ClF2O4S
UNII
9JD9B4S53T
MDL number
MFCD21608529
InChIKey
XCGJIFAKUZNNOR-UHFFFAOYSA-N
InChI
InChI=1S/C21H21ClF2O4S/c22-15-2-5-17(6-3-15)29(27,28)21(18-13-16(23)4-7-19(18)24)11-9-14(10-12-21)1-8-20(25)26/h2-7,13-14H,1,8-12H2,(H,25,26)
SMILES (canonical and isomeric)
C1CC(CCC1CCC(=O)O)(C2=C(C=CC(=C2)F)F)S(=O)(=O)C3=CC=C(C=C3)Cl

Synonyms

  • MK 0752
  • 3-[4-(4-chlorophenyl)sulfonyl-4-(2,5-difluorophenyl)cyclohexyl]propanoic Acid
  • Cyclohexanepropanoic acid, 4-((4-chlorophenyl)sulfonyl)-4-(2,5-difluorophenyl)-, cis-
  • 3-[(1s,4r)-4-(4-chlorobenzenesulfonyl)-4-(2,5-difluorophenyl)cyclohexyl]propanoic acid
  • Cyclohexanepropanoic acid, 4-[(4-chlorophenyl)sulfonyl]-4-(2,5-difluorophenyl)-, cis-
  • 3-((1s,4r)-4-(4-chlorobenzenesulfonyl)-4-(2,5-difluorophenyl)cyclohexyl)propanoic acid
  • 3-(4-(4-chlorophenyl)sulfonyl-4-(2,5-difluorophenyl)cyclohexyl)propanoic acid
  • Notch signaling pathway inhibitor mk0752
  • cis-4-[(4-Chlorophenyl)sulfonyl]-4-(2,5-difluorophenyl)cyclohexanepropanoic acid
  • 3-((1r,4s)-4-((4-chlorophenyl)sulfonyl)-4-(2,5-difluorophenyl)cyclohexyl)propanoic acid
  • 3-(cis-4-((4-Chlorophenyl)sulfonyl)-4-(2,5-difluorophenyl)cyclohexyl)propanoic acid
  • C21H21ClF2O4S
  • 3-((1r,4s)-4-(4-chlorophenylsulfonyl)-4-(2,5-difluorophenyl)cyclohexyl)propanoic acid
  • 3-[cis-4-[(4-Chlorophenyl)sulfonyl]-4-(2,5-difluorophenyl)cyclohexyl]propanoic Acid
  • 5-O-Demethyltangeretin
  • MK0752?
  • 3-((1r,4s)-4-((4-chlorophenyl)sulfonyl)-4-(2,5-difluorophenyl)cyclohexyl)propanoic acid.
  • 3-[(1R,4S)-4-(4-Chlorobenzenesulfonyl)-4-(2,5-difluorophenyl)cyclohexyl]propanoic acid
  • 3-[4-(4-Chlorobenzene-1-sulfonyl)-4-(2,5-difluorophenyl)cyclohexyl]propanoic acid

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
442.91 g/molcalc.
Exact mass
442.0817 Dacalc.
LogP (octanol/water)
5.34calc.
Topological polar surface area
71.44 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
6calc.
Heavy atoms
29calc.
Rings
3calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.38calc.
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, O=S(=O)(c1ccccc1)C1(c2ccccc2)CCCCC1

O=S(=O)(c1ccccc1)C1(c2ccccc2)CCCCC1

3 rings, 21 atoms.

12 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Danger
GHS05: Corrosive
Corrosive
GHS07: Harmful or irritant
Harmful or irritant
GHS08: Serious health hazard
Serious health hazard

Hazard statements

  • H302Harmful if swallowed.
  • H318Causes serious eye damage.
  • H360May damage fertility or the unborn child.
  • H371May cause damage to organs.
  • H373May cause damage to organs through prolonged or repeated exposure.
Precautionary statements (15)
  • P203Obtain, read and follow all safety instructions before use.
  • P260Do not breathe dust, fume, gas, mist, vapours or spray.
  • P264Wash skin thoroughly after handling.
  • P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
  • P270Do not eat, drink or smoke when using this product.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P301 + P317If swallowed: Get medical help.
  • P305 + P354 + P338If in eyes: Immediately rinse with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P308 + P316If exposed or concerned: Get emergency medical help immediately.
  • P317Get medical help.
  • P318If exposed or concerned, get medical advice.
  • P319Get medical help if you feel unwell.
  • P330Rinse mouth.
  • P405Store locked up.
  • 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

Mk-0752 suppliers

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

All 9 suppliers
9 of 9 offers

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Where suppliers are based

9 suppliers in 3 countries

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Mk-0752 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 Mk-0752 is traded under.

HS 2930.90Indicative HS code

Organo-sulphur compounds, other

World exports in 2024
$5.83B
+0.1% vs 2023, imports $5.93B
2019 to 2024
Top exporters
  1. China40.7%
  2. United States10.9%
  3. Japan9.3%
Top importers
  1. United States13.3%
  2. Brazil12.6%
  3. China6.6%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Mk-0752 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Mk-0752, based on the data on this page

What is Mk-0752?

Notch Signaling Pathway Inhibitor MK0752 is a synthetic small molecule with potential antineoplastic activity. MK0752 inhibits the Notch signaling pathway, which may result in induction of growth arrest and apoptosis in tumor cells in which the Notch signaling pathway is overactivated.

Is Mk-0752 hazardous?

Mk-0752 carries the GHS signal word "Danger". Main hazards: harmful if swallowed, causes serious eye damage, may damage fertility or the unborn child. This summary is not an SDS, always read the supplier safety data sheet.

Guides for buyers

Practical guides that help when you source, ship or handle Mk-0752

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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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