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Screening compounds

Selatinib

Also known as 4-Quinazolinamine, N-(3-chloro-4-((3-fluorophenyl)methoxy)phenyl)-6-(5-(((2-(methylsulfinyl)ethyl)amino)methyl)-2-furanyl)-, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfinylethylamino)methyl]furan-2-yl]quinazolin-4-amine, N-(3-chloro-4-((3-fluorophenyl)methoxy)phenyl)-6-(5-((2-methylsulfinylethylamino)methyl)furan-2-yl)quinazolin-4-amine

CAS 1275595-86-2Formula C29H26ClFN4O3SMolar mass 565.07 g/mol
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Selatinib chemical structure, C29H26ClFN4O3S, CAS 1275595-86-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1275595-86-2
Formula
C29H26ClFN4O3S
Molar mass
565.07 g/mol
HS code
293499
Category
Screening compounds

What is Selatinib?

Plain description, key identifiers and synonyms

Selatinib is an orally bioavailable dual inhibitor of epidermal growth factor receptor (EGFR) and human epidermal growth factor receptor 2 (ErbB-2 or HER-2), and an analog of the quinazoline lapatinib, with potential antineoplastic activity. Upon administration, selatinib reversibly blocks phosphorylation of both EGFR and ErbB2, thereby suppressing tumor growth in EGFR/ErbB-2-overexpressing tumor cells. The tyrosine kinases EGFR and ErbB2 have been implicated in the growth of various tumor types.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfinylethylamino)methyl]furan-2-yl]quinazolin-4-amine
CAS number
1275595-86-2
Molecular formula
C29H26ClFN4O3S
UNII
6TLR8U8O3C
InChIKey
OAMVGUFHZPRXOM-UHFFFAOYSA-N
InChI
InChI=1S/C29H26ClFN4O3S/c1-39(36)12-11-32-16-23-7-10-27(38-23)20-5-8-26-24(14-20)29(34-18-33-26)35-22-6-9-28(25(30)15-22)37-17-19-3-2-4-21(31)13-19/h2-10,13-15,18,32H,11-12,16-17H2,1H3,(H,33,34,35)
SMILES (canonical and isomeric)
CS(=O)CCNCC1=CC=C(O1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Cl

Synonyms

  • 4-Quinazolinamine, N-(3-chloro-4-((3-fluorophenyl)methoxy)phenyl)-6-(5-(((2-(methylsulfinyl)ethyl)amino)methyl)-2-furanyl)-
  • N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfinylethylamino)methyl]furan-2-yl]quinazolin-4-amine
  • N-(3-chloro-4-((3-fluorophenyl)methoxy)phenyl)-6-(5-((2-methylsulfinylethylamino)methyl)furan-2-yl)quinazolin-4-amine
  • N-(3-chloro-4-((3-fluorobenzyl)oxy)phenyl)-6-(5-(((2-(methylsulfinyl)ethyl)amino)methyl)furan-2-yl)quinazolin-4-amine
  • N-{3-chloro-4-[(3-fluorophenyl)methoxy]phenyl}-6-(5-{[(2-methanesulfinylethyl)amino]methyl}furan-2-yl)quinazolin-4-amine
  • US8916574, Compound 2

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
565.07 g/molcalc.
Exact mass
564.1398 Dacalc.
LogP (octanol/water)
6.47calc.
Topological polar surface area
89.28 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
7calc.
Rotatable bonds
11calc.
Heavy atoms
39calc.
Rings
5calc.
Aromatic rings
5calc.
Fraction sp3 carbons
0.17calc.
Formal charge
0calc.
Stereocentres
1calc.
Lipinski rule of five
Fails (2 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, c1ccc(COc2ccc(Nc3ncnc4ccc(-c5ccco5)cc34)cc2)cc1

c1ccc(COc2ccc(Nc3ncnc4ccc(-c5ccco5)cc34)cc2)cc1

5 rings, 30 atoms.

39 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.

Selatinib suppliers

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Selatinib 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.

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

Frequently asked questions

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

What is Selatinib?

Selatinib is an orally bioavailable dual inhibitor of epidermal growth factor receptor (EGFR) and human epidermal growth factor receptor 2 (ErbB-2 or HER-2), and an analog of the quinazoline lapatinib, with potential antineoplastic activity.

What is the CAS number of Selatinib?

The CAS registry number of Selatinib is 1275595-86-2.

What is the molecular formula and weight of Selatinib?

The molecular formula of Selatinib is C29H26ClFN4O3S and its molar mass is 565.07 g/mol.

What is Selatinib used for?

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

Is Selatinib hazardous?

No GHS hazard classification for Selatinib 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 Selatinib?

Selatinib 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 Selatinib?

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

What is the price of Selatinib?

Suppliers quote Selatinib 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 Selatinib

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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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