CompoundList
Sign in
Screening compounds

Win 52084

Also known as Isoxazole, 5-[7-[4-[(4S)-4,5-dihydro-4-methyl-2-oxazolyl]phenoxy]heptyl]-3-methyl-, (S)-3-Methyl-5-(7-(4-(4-methyl-4,5-dihydrooxazol-2-yl)phenoxy)heptyl)isoxazole, 3-methyl-5-(7-{4-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenoxy}heptyl)-1,2-oxazole

CAS 98102-61-5Formula C21H28N2O3Molar mass 356.47 g/mol
Get quotes Safety data
Win 52084 chemical structure, C21H28N2O3, CAS 98102-61-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
98102-61-5
Formula
C21H28N2O3
Molar mass
356.47 g/mol
HS code
293499
Category
Screening compounds

What is Win 52084?

Plain description, key identifiers and synonyms

Win 52084 is a chemical substance with the molecular formula C21H28N2O3 and a molar mass of 356.47 g/mol. Its CAS registry number is 98102-61-5. The IUPAC name is 3-methyl-5-[7-[4-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenoxy]heptyl]-1,2-oxazole.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-methyl-5-[7-[4-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenoxy]heptyl]-1,2-oxazole
CAS number
98102-61-5 CAS number cross-checked
Molecular formula
C21H28N2O3
InChIKey
NEAZMARKCJKUMF-KRWDZBQOSA-N
InChI
InChI=1S/C21H28N2O3/c1-16-14-20(26-23-16)8-6-4-3-5-7-13-24-19-11-9-18(10-12-19)21-22-17(2)15-25-21/h9-12,14,17H,3-8,13,15H2,1-2H3/t17-/m0/s1
Canonical SMILES
Cc1cc(CCCCCCCOc2ccc(C3=NC(C)CO3)cc2)on1
Isomeric SMILES
C[C@H]1COC(=N1)C2=CC=C(C=C2)OCCCCCCCC3=CC(=NO3)C

Synonyms

  • Isoxazole, 5-[7-[4-[(4S)-4,5-dihydro-4-methyl-2-oxazolyl]phenoxy]heptyl]-3-methyl-
  • (S)-3-Methyl-5-(7-(4-(4-methyl-4,5-dihydrooxazol-2-yl)phenoxy)heptyl)isoxazole
  • 3-methyl-5-(7-{4-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenoxy}heptyl)-1,2-oxazole
  • 3-methyl-5-[7-[4-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenoxy]heptyl]-1,2-oxazole
  • 5-(7-(5-hydro-4-methyl-2-oxazolyl)phenoxy)heptyl)-3-methyl isoxazole
  • 3-Methyl-5-{7-[4-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)phenoxy]heptyl}-1,2-oxazole
  • 5-(7-(4-(4,5-Dihydro-4-methyl-2-oxazolyl)phenoxy)heptyl)-3-methylisoxazole
  • WIN I(S), WIN 52084 (S)
  • 3-methyl-5-(7-{4-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenoxy}heptyl)isoxazole
  • 3-methyl-5-[7-[4-[(4S)-4-methyl-4,5-dihydrooxazol-2-yl]phenoxy]heptyl]isoxazole
  • Isoxazole, 5-(7-(4-(4,5-dihydro-4-methyl-2-oxazolyl)phenoxy)heptyl)-3-methyl-, (S)-

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
356.47 g/molcalc.
Exact mass
356.21 Dacalc.
LogP (octanol/water)
4.72calc.
Topological polar surface area
56.85 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
10calc.
Heavy atoms
26calc.
Rings
3calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.52calc.
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, c1cc(CCCCCCCOc2ccc(C3=NCCO3)cc2)on1

c1cc(CCCCCCCOc2ccc(C3=NCCO3)cc2)on1

3 rings, 24 atoms.

17 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.

Win 52084 suppliers

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

No supplier listings yet

Post one free request and suppliers who make or trade Win 52084 can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

Win 52084 price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

Get latest price

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 Win 52084 is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024
$26.7B
+15.0% vs 2023, imports $26.3B
2019 to 2024
Top exporters
  1. Ireland26.3%
  2. China15.7%
  3. Singapore10.3%
Top importers
  1. United States24.5%
  2. Germany23.1%
  3. Japan4.5%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Win 52084 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Win 52084, based on the data on this page

What is Win 52084?

Win 52084 is a chemical substance with the molecular formula C21H28N2O3 and a molar mass of 356.47 g/mol. Its CAS registry number is 98102-61-5. The IUPAC name is 3-methyl-5-[7-[4-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]phenoxy]heptyl]-1,2-oxazole.

What is the CAS number of Win 52084?

The CAS registry number of Win 52084 is 98102-61-5.

What is the molecular formula and weight of Win 52084?

The molecular formula of Win 52084 is C21H28N2O3 and its molar mass is 356.47 g/mol.

What is Win 52084 used for?

Known uses and roles of Win 52084 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Win 52084 hazardous?

No GHS hazard classification for Win 52084 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 Win 52084?

Win 52084 is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Win 52084?

Post a free request on CompoundList and suppliers of Win 52084 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Win 52084?

Suppliers quote Win 52084 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

Practical guides that help when you source, ship or handle Win 52084

Get quotes for Win 52084

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell Win 52084
Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
Embed this structure on your websiteShow code

Paste this code into your page to show the 2D structure of Win 52084 with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/win-52084-98102-61-5" title="Win 52084 structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>
Preview the embed

Explore more in Screening compounds or HS code 293499

Price on request
Free quotes, contact stays private
Get quotes