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Screening compounds

Sunobinop

Also known as WHO 11537, 4-[(1R,5S)-9-[(1S,5S)-3-bicyclo[3.3.1]nonanyl]-9-azabicyclo[3.3.1]nonan-3-yl]-3-oxoquinoxaline-2-carboxylic acid, 2-Quinoxalinecarboxylic acid, 4-((3-endo)-9-(3-exo)-bicyclo(3.3.1)non-3-yl-9-azabicyclo(3.3.1)non-3-yl)-3,4-dihydro-3-oxo-

CAS 1126793-40-5Formula C26H33N3O3Molar mass 435.57 g/mol
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Sunobinop chemical structure, C26H33N3O3, CAS 1126793-40-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1126793-40-5
Formula
C26H33N3O3
Molar mass
435.57 g/mol
HS code
293399
Category
Screening compounds

What is Sunobinop?

Plain description, key identifiers and synonyms

Sunobinop is a chemical substance with the molecular formula C26H33N3O3 and a molar mass of 435.57 g/mol. Its CAS registry number is 1126793-40-5. The IUPAC name is 4-[(1R,5S)-9-[(1S,5S)-3-bicyclo[3.3.1]nonanyl]-9-azabicyclo[3.3.1]nonan-3-yl]-3-oxoquinoxaline-2-carboxylic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4-[(1R,5S)-9-[(1S,5S)-3-bicyclo[3.3.1]nonanyl]-9-azabicyclo[3.3.1]nonan-3-yl]-3-oxoquinoxaline-2-carboxylic acid
CAS number
1126793-40-5
Molecular formula
C26H33N3O3
UNII
I1X86U5474
InChIKey
COTYYZPYDJKKIS-MCXOOUIESA-N
InChI
InChI=1S/C26H33N3O3/c30-25-24(26(31)32)27-22-9-1-2-10-23(22)29(25)21-14-18-7-4-8-19(15-21)28(18)20-12-16-5-3-6-17(11-16)13-20/h1-2,9-10,16-21H,3-8,11-15H2,(H,31,32)/t16-,17-,18-,19+,21?/m0/s1
Canonical SMILES
O=C(O)c1nc2ccccc2n(C2CC3CCCC(C2)N3C2CC3CCCC(C3)C2)c1=O
Isomeric SMILES
C1C[C@H]2C[C@H](C1)CC(C2)N3[C@@H]4CCC[C@H]3CC(C4)N5C6=CC=CC=C6N=C(C5=O)C(=O)O

Synonyms

  • WHO 11537
  • 4-[(1R,5S)-9-[(1S,5S)-3-bicyclo[3.3.1]nonanyl]-9-azabicyclo[3.3.1]nonan-3-yl]-3-oxoquinoxaline-2-carboxylic acid
  • 2-Quinoxalinecarboxylic acid, 4-((3-endo)-9-(3-exo)-bicyclo(3.3.1)non-3-yl-9-azabicyclo(3.3.1)non-3-yl)-3,4-dihydro-3-oxo-
  • 4-((1R,1'R,3R,3'R,5S,5'S)-9'-Aza(3,9'- bi(bicyclo(3.3.1)nonan))-3'-yl)-3-oxo-3,4- dihydroquinoxaline-2-carboxylic 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
435.57 g/molcalc.
Exact mass
435.2522 Dacalc.
LogP (octanol/water)
4.62calc.
Topological polar surface area
75.43 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
3calc.
Heavy atoms
32calc.
Rings
6calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.65calc.
Formal charge
0calc.
Stereocentres
5calc.
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, O=c1cnc2ccccc2n1C1CC2CCCC(C1)N2C1CC2CCCC(C2)C1

O=c1cnc2ccccc2n1C1CC2CCCC(C1)N2C1CC2CCCC(C2)C1

6 rings, 29 atoms.

1 other chemical 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.

Sunobinop suppliers

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Sunobinop 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 Sunobinop is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Sunobinop?

Sunobinop is a chemical substance with the molecular formula C26H33N3O3 and a molar mass of 435.57 g/mol. Its CAS registry number is 1126793-40-5. The IUPAC name is 4-[(1R,5S)-9-[(1S,5S)-3-bicyclo[3.3.1]nonanyl]-9-azabicyclo[3.3.1]nonan-3-yl]-3-oxoquinoxaline-2-carboxylic acid.

What is the CAS number of Sunobinop?

The CAS registry number of Sunobinop is 1126793-40-5.

What is the molecular formula and weight of Sunobinop?

The molecular formula of Sunobinop is C26H33N3O3 and its molar mass is 435.57 g/mol.

What is Sunobinop used for?

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

Is Sunobinop hazardous?

No GHS hazard classification for Sunobinop 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 Sunobinop?

Sunobinop is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Sunobinop?

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What is the price of Sunobinop?

Suppliers quote Sunobinop on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

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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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