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Screening compounds

Mrk-560

Also known as MRK 560, N-[4-(4-chlorophenyl)sulfonyl-4-(2,5-difluorophenyl)cyclohexyl]-1,1,1-trifluoromethanesulfonamide, n-[cis-4-[(4-chlorophenyl)sulfonyl]-4-(2,5-difluorophenyl)cyclohexyl]-1,1,1-trifluoromethanesulfonamide

CAS 677772-84-8Formula C19H17ClF5NO4S2Molar mass 517.93 g/molEC 112-628-3
GHS signal word: Warning. Pictograms: Harmful or irritant 1 supplier listed
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Mrk-560 chemical structure, C19H17ClF5NO4S2, CAS 677772-84-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
677772-84-8
Formula
C19H17ClF5NO4S2
Molar mass
517.93 g/mol
EC number
112-628-3
HS code
293590
Category
Screening compounds

What is Mrk-560?

Plain description, key identifiers and synonyms

Mrk-560 is a chemical substance with the molecular formula C19H17ClF5NO4S2 and a molar mass of 517.93 g/mol. Its CAS registry number is 677772-84-8. The IUPAC name is N-[4-(4-chlorophenyl)sulfonyl-4-(2,5-difluorophenyl)cyclohexyl]-1,1,1-trifluoromethanesulfonamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
N-[4-(4-chlorophenyl)sulfonyl-4-(2,5-difluorophenyl)cyclohexyl]-1,1,1-trifluoromethanesulfonamide
CAS number
677772-84-8Other or deprecated CAS: 2443966-95-6
EC number
112-628-3
Molecular formula
C19H17ClF5NO4S2
InChIKey
WDZVWDXOIGQJIO-UHFFFAOYSA-N
InChI
InChI=1S/C19H17ClF5NO4S2/c20-12-1-4-15(5-2-12)31(27,28)18(16-11-13(21)3-6-17(16)22)9-7-14(8-10-18)26-32(29,30)19(23,24)25/h1-6,11,14,26H,7-10H2
SMILES (canonical and isomeric)
C1CC(CCC1NS(=O)(=O)C(F)(F)F)(C2=C(C=CC(=C2)F)F)S(=O)(=O)C3=CC=C(C=C3)Cl

Synonyms

  • MRK 560
  • N-[4-(4-chlorophenyl)sulfonyl-4-(2,5-difluorophenyl)cyclohexyl]-1,1,1-trifluoromethanesulfonamide
  • n-[cis-4-[(4-chlorophenyl)sulfonyl]-4-(2,5-difluorophenyl)cyclohexyl]-1,1,1-trifluoromethanesulfonamide
  • N-(cis-4-((4-Chlorophenyl)sulfonyl)-4-(2,5-difluorophenyl)cyclohexyl)-1,1,1-trifluoromethanesulfonamide
  • C19H17ClF5NO4S2
  • cyclohexyl sulfone-based compound, 32
  • N-((1s,4s)-4-((4-chlorophenyl)sulfonyl)-4-(2,5-difluorophenyl)cyclohexyl)-1,1,1-trifluoromethanesulfonamide
  • N-[4-(4-chlorophenyl)sulfonyl-4-(2,5-difluorophenyl)cyclohexyl]-1,1,1-trifluoro-methanesulfonamide
  • IGD
  • N-{4-[(4-chlorobenzene)sulfonyl]-4-(2,5-difluorophenyl)cyclohexyl}trifluoromethanesulfonamide
  • trifluoromethanesulfonic acid, N-[4-(4-chlorobenzenesulfonyl)-4-(2,5-difluorophenyl)-cyclohexyl]-amide

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
517.93 g/molcalc.
Exact mass
517.0208 Dacalc.
LogP (octanol/water)
4.67calc.
Topological polar surface area
80.31 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
5calc.
Heavy atoms
32calc.
Rings
3calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.37calc.
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
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H315Causes skin irritation.
  • H319Causes serious eye irritation.
Precautionary statements (9)
  • P264Wash skin thoroughly after handling.
  • P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P302 + P352If on skin: Wash with plenty of water.
  • P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P332 + P317If skin irritation occurs: Get medical help.
  • P337 + P317If eye irritation persists: Get medical help.
  • P362 + P364Take off contaminated clothing. And wash it before reuse.

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

Mrk-560 suppliers

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

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  • Synblock Inc
    Canada, MontrealUnclaimed profile
    Mrk-560Grade, purity and minimum order on request
    Price on request
    View

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Where suppliers are based

1 supplier in 1 country

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Mrk-560 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

  • Gamma Secretase Inhibitors and Modulators

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 Mrk-560 is traded under.

HS 2935.90Indicative HS code

Sulphonamides, other

World exports in 2024
$5.64B
−11.0% vs 2023, imports $8.56B
2019 to 2024
Top exporters
  1. Ireland43.1%
  2. China12.0%
  3. India * partner reported9.5%
Top importers
  1. United States23.6%
  2. Slovenia19.1%
  3. Spain11.7%

* Partner reported figures, a lower bound.

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

The HS code shown for Mrk-560 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Mrk-560, based on the data on this page

What is Mrk-560?

Mrk-560 is a chemical substance with the molecular formula C19H17ClF5NO4S2 and a molar mass of 517.93 g/mol. Its CAS registry number is 677772-84-8. The IUPAC name is N-[4-(4-chlorophenyl)sulfonyl-4-(2,5-difluorophenyl)cyclohexyl]-1,1,1-trifluoromethanesulfonamide.

What is the CAS number of Mrk-560?

The CAS registry number of Mrk-560 is 677772-84-8. Other or deprecated CAS numbers: 2443966-95-6.

What is the molecular formula and weight of Mrk-560?

The molecular formula of Mrk-560 is C19H17ClF5NO4S2 and its molar mass is 517.93 g/mol.

What is Mrk-560 used for?

Known uses and roles of Mrk-560 include building blocks in research and laboratory, screening compounds in research and laboratory and gamma secretase inhibitors and modulators.

Is Mrk-560 hazardous?

Mrk-560 carries the GHS signal word "Warning". Main hazards: causes skin irritation, causes serious eye irritation. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Mrk-560?

Mrk-560 is usually classified under HS code 293590 (Sulphonamides, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Mrk-560?

CompoundList lists 1 supplier of Mrk-560 in Canada. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Mrk-560?

Suppliers quote Mrk-560 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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