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Screening compounds

Orb2283340

Formula C27H41ClN4O5Molar mass 537.10 g/mol
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Orb2283340 chemical structure, C27H41ClN4O5
2D chemical structure

Key facts

What buyers check first

All properties
Formula
C27H41ClN4O5
Molar mass
537.10 g/mol
HS code
293339
Category
Screening compounds

What is Orb2283340?

Plain description, key identifiers and synonyms

Orb2283340 is a chemical substance with the molecular formula C27H41ClN4O5 and a molar mass of 537.10 g/mol. The IUPAC name is [2,4-di(propan-2-yloxy)phenyl] 2-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-4-carboxylate, hydrochloride.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[2,4-di(propan-2-yloxy)phenyl] 2-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-4-carboxylate, hydrochloride
Molecular formula
C27H41ClN4O5
InChIKey
BFUSTXOCGGLLEX-UHFFFAOYSA-N
InChI
InChI=1S/C27H40N4O5.ClH/c1-8-31(14-13-30(6)7)26(32)18-28-17-22-15-21(11-12-29-22)27(33)36-24-10-9-23(34-19(2)3)16-25(24)35-20(4)5;/h9-12,15-16,19-20,28H,8,13-14,17-18H2,1-7H3;1H
SMILES (canonical and isomeric)
CCN(CCN(C)C)C(=O)CNCC1=NC=CC(=C1)C(=O)OC2=C(C=C(C=C2)OC(C)C)OC(C)C.Cl

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
537.10 g/molcalc.
Exact mass
536.2765 Dacalc.
LogP (octanol/water)
3.8calc.
Topological polar surface area
93.23 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
14calc.
Heavy atoms
37calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.52calc.
Formal charge
0calc.
Stereocentres
0calc.
Components
2calc.
Lipinski rule of five
Passes (1 violation)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=C(Oc1ccccc1)c1ccncc1

O=C(Oc1ccccc1)c1ccncc1

2 rings, 15 atoms, the Phenyl isonicotinate ring system.

24 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.

Orb2283340 suppliers

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Orb2283340 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 Orb2283340 is traded under.

HS 2933.39Indicative HS code

Heterocyclic compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure…

World exports in 2024
$9.16B
−17.9% vs 2023, imports $10.6B
2019 to 2024
Top exporters
  1. China21.5%
  2. India * partner reported12.3%
  3. Ireland11.6%
Top importers
  1. Germany14.2%
  2. United States12.8%
  3. Brazil10.1%

* Partner reported figures, a lower bound.

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

The HS code shown for Orb2283340 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb2283340, based on the data on this page

What is Orb2283340?

Orb2283340 is a chemical substance with the molecular formula C27H41ClN4O5 and a molar mass of 537.10 g/mol. The IUPAC name is [2,4-di(propan-2-yloxy)phenyl] 2-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-4-carboxylate, hydrochloride.

What is the molecular formula and weight of Orb2283340?

The molecular formula of Orb2283340 is C27H41ClN4O5 and its molar mass is 537.10 g/mol.

What is Orb2283340 used for?

Known uses and roles of Orb2283340 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Orb2283340 hazardous?

No GHS hazard classification for Orb2283340 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 Orb2283340?

Orb2283340 is usually classified under HS code 293339 (Compounds containing an unfused pyridine ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Orb2283340?

Post a free request on CompoundList and suppliers of Orb2283340 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb2283340?

Suppliers quote Orb2283340 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 Orb2283340

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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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