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Screening compounds

4L7D8U6Jbb

Also known as 4-((6,7-Dimethoxyquinolin-4-yl)amino)phenol hydrochloride, Phenol, 4-[(6,7-dimethoxy-4-quinolinyl)amino]-, monohydrochloride, Phenol, 4-[(6,7-dimethoxy-4-quinolinyl)amino]-, hydrochloride (1:1)

CAS 35654-35-4Formula C17H17ClN2O3Molar mass 332.79 g/mol
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4L7D8U6Jbb chemical structure, C17H17ClN2O3, CAS 35654-35-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
35654-35-4
Formula
C17H17ClN2O3
Molar mass
332.79 g/mol
HS code
293349
Category
Screening compounds

What is 4L7D8U6Jbb?

Plain description, key identifiers and synonyms

4L7D8U6Jbb is a chemical substance with the molecular formula C17H17ClN2O3 and a molar mass of 332.79 g/mol. Its CAS registry number is 35654-35-4. The IUPAC name is 4-[(6,7-dimethoxyquinolin-4-yl)amino]phenol, hydrochloride.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4-[(6,7-dimethoxyquinolin-4-yl)amino]phenol, hydrochloride
CAS number
35654-35-4
Molecular formula
C17H17ClN2O3
UNII
4L7D8U6JBB
InChIKey
VLYXCQSBGXYCCB-UHFFFAOYSA-N
InChI
InChI=1S/C17H16N2O3.ClH/c1-21-16-9-13-14(19-11-3-5-12(20)6-4-11)7-8-18-15(13)10-17(16)22-2;/h3-10,20H,1-2H3,(H,18,19);1H
SMILES (canonical and isomeric)
COC1=CC2=C(C=CN=C2C=C1OC)NC3=CC=C(C=C3)O.Cl

Synonyms

  • 4-((6,7-Dimethoxyquinolin-4-yl)amino)phenol hydrochloride
  • Phenol, 4-[(6,7-dimethoxy-4-quinolinyl)amino]-, monohydrochloride
  • Phenol, 4-[(6,7-dimethoxy-4-quinolinyl)amino]-, hydrochloride (1:1)

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
332.79 g/molcalc.
Exact mass
332.0928 Dacalc.
LogP (octanol/water)
4.12calc.
Topological polar surface area
63.61 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
4calc.
Heavy atoms
23calc.
Rings
3calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.12calc.
Formal charge
0calc.
Stereocentres
0calc.
Components
2calc.
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, c1ccc(Nc2ccnc3ccccc23)cc1

c1ccc(Nc2ccnc3ccccc23)cc1

3 rings, 17 atoms, the N-Phenylquinolin-4-amine ring system.

660 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.

4L7D8U6Jbb suppliers

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4L7D8U6Jbb price

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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 4L7D8U6Jbb is traded under.

HS 2933.49Indicative HS code

Compounds containing in the structure a quinoline or isoquinoline ring-system (whether…

World exports in 2024
$939M
−14.6% vs 2023, imports $1.48B
2019 to 2024
Top exporters
  1. China30.1%
  2. India * partner reported16.7%
  3. Switzerland * partner reported14.1%
Top importers
  1. United Kingdom19.2%
  2. Germany16.0%
  3. Romania8.3%

* Partner reported figures, a lower bound.

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

The HS code shown for 4L7D8U6Jbb is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 4L7D8U6Jbb, based on the data on this page

What is 4L7D8U6Jbb?

4L7D8U6Jbb is a chemical substance with the molecular formula C17H17ClN2O3 and a molar mass of 332.79 g/mol. Its CAS registry number is 35654-35-4. The IUPAC name is 4-[(6,7-dimethoxyquinolin-4-yl)amino]phenol, hydrochloride.

What is the CAS number of 4L7D8U6Jbb?

The CAS registry number of 4L7D8U6Jbb is 35654-35-4.

What is the molecular formula and weight of 4L7D8U6Jbb?

The molecular formula of 4L7D8U6Jbb is C17H17ClN2O3 and its molar mass is 332.79 g/mol.

What is 4L7D8U6Jbb used for?

Known uses and roles of 4L7D8U6Jbb include building blocks in research and laboratory and screening compounds in research and laboratory.

Is 4L7D8U6Jbb hazardous?

No GHS hazard classification for 4L7D8U6Jbb 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 4L7D8U6Jbb?

4L7D8U6Jbb is usually classified under HS code 293349 (Compounds containing in the structure a quinoline or isoquinoline ring-system (whether…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 4L7D8U6Jbb?

Post a free request on CompoundList and suppliers of 4L7D8U6Jbb will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 4L7D8U6Jbb?

Suppliers quote 4L7D8U6Jbb 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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