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Screening compounds

Orb1707149

Also known as K-252b,

Formula C26H19N3O5Molar mass 453.45 g/mol
1 supplier listed
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Orb1707149 chemical structure, C26H19N3O5
2D chemical structure

Key facts

What buyers check first

All properties
Formula
C26H19N3O5
Molar mass
453.45 g/mol
HS code
293499
Category
Screening compounds

What is Orb1707149?

Plain description, key identifiers and synonyms

Orb1707149 is a chemical substance with the molecular formula C26H19N3O5 and a molar mass of 453.45 g/mol. The IUPAC name is 16-hydroxy-15-methyl-3-oxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8,10,12,20,22,24,26-nonaene-16-carboxylic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
16-hydroxy-15-methyl-3-oxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8,10,12,20,22,24,26-nonaene-16-carboxylic acid
Molecular formula
C26H19N3O5
InChIKey
AMSOPBXQXSAAAC-UHFFFAOYSA-N
InChI
InChI=1S/C26H19N3O5/c1-25-26(33,24(31)32)10-17(34-25)28-15-8-4-2-6-12(15)19-20-14(11-27-23(20)30)18-13-7-3-5-9-16(13)29(25)22(18)21(19)28/h2-9,17,33H,10-11H2,1H3,(H,27,30)(H,31,32)
SMILES (canonical and isomeric)
CC12C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)(C(=O)O)O

Synonyms

  • K-252b,

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
453.45 g/molcalc.
Exact mass
453.1325 Dacalc.
LogP (octanol/water)
3.57calc.
Topological polar surface area
105.7 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
1calc.
Heavy atoms
34calc.
Rings
8calc.
Aromatic rings
5calc.
Fraction sp3 carbons
0.23calc.
Formal charge
0calc.
Stereocentres
3calc.
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=C1NCc2c1c1c3ccccc3n3c1c1c2c2ccccc2n1C1CCC3O1

O=C1NCc2c1c1c3ccccc3n3c1c1c2c2ccccc2n1C1CCC3O1

8 rings, 29 atoms.

25 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.

Orb1707149 suppliers

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  • Hello Bio
    United Kingdom, AvonmouthUnclaimed profile
    Orb1707149Grade, purity and minimum order on request
    Price on request
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Where suppliers are based

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Orb1707149 price

Indicative price range per kg from live supplier offers

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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 Orb1707149 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 Orb1707149 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb1707149, based on the data on this page

What is Orb1707149?

Orb1707149 is a chemical substance with the molecular formula C26H19N3O5 and a molar mass of 453.45 g/mol. The IUPAC name is 16-hydroxy-15-methyl-3-oxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8,10,12,20,22,24,26-nonaene-16-carboxylic acid.

What is the molecular formula and weight of Orb1707149?

The molecular formula of Orb1707149 is C26H19N3O5 and its molar mass is 453.45 g/mol.

What is Orb1707149 used for?

Known uses and roles of Orb1707149 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Orb1707149 hazardous?

No GHS hazard classification for Orb1707149 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 Orb1707149?

Orb1707149 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 Orb1707149?

CompoundList lists 1 supplier of Orb1707149 in United Kingdom. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Orb1707149?

Suppliers quote Orb1707149 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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