CompoundList
Sign in
Screening compounds

Orb3174644

Also known as VK4-116, >98% (HPLC), (+/-)-N-(4-(4-(3-chloro-5-ethyl-2-methoxyphenyl)piperazin-1-yl)-3-hydroxybutyl)-1h-indole-2-carboxamide, N-[4-[4-(3-chloro-5-ethyl-2-methoxyphenyl)piperazin-1-yl]-3-hydroxybutyl]-1H-indole-2-carboxamide

CAS 1982347-43-2Formula C26H33ClN4O3Molar mass 485.03 g/mol
Get quotes Safety data
Orb3174644 chemical structure, C26H33ClN4O3, CAS 1982347-43-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1982347-43-2
Formula
C26H33ClN4O3
Molar mass
485.03 g/mol
HS code
293359
Category
Screening compounds

What is Orb3174644?

Plain description, key identifiers and synonyms

Orb3174644 is a chemical substance with the molecular formula C26H33ClN4O3 and a molar mass of 485.03 g/mol. Its CAS registry number is 1982347-43-2. The IUPAC name is N-[4-[4-(3-chloro-5-ethyl-2-methoxyphenyl)piperazin-1-yl]-3-hydroxybutyl]-1H-indole-2-carboxamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
N-[4-[4-(3-chloro-5-ethyl-2-methoxyphenyl)piperazin-1-yl]-3-hydroxybutyl]-1H-indole-2-carboxamide
CAS number
1982347-43-2
Molecular formula
C26H33ClN4O3
InChIKey
NRSBRNRWCATXOT-UHFFFAOYSA-N
InChI
InChI=1S/C26H33ClN4O3/c1-3-18-14-21(27)25(34-2)24(15-18)31-12-10-30(11-13-31)17-20(32)8-9-28-26(33)23-16-19-6-4-5-7-22(19)29-23/h4-7,14-16,20,29,32H,3,8-13,17H2,1-2H3,(H,28,33)
SMILES (canonical and isomeric)
CCC1=CC(=C(C(=C1)Cl)OC)N2CCN(CC2)CC(CCNC(=O)C3=CC4=CC=CC=C4N3)O

Synonyms

  • VK4-116, >98% (HPLC)
  • (+/-)-N-(4-(4-(3-chloro-5-ethyl-2-methoxyphenyl)piperazin-1-yl)-3-hydroxybutyl)-1h-indole-2-carboxamide
  • N-[4-[4-(3-chloro-5-ethyl-2-methoxyphenyl)piperazin-1-yl]-3-hydroxybutyl]-1H-indole-2-carboxamide

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
485.03 g/molcalc.
Exact mass
484.2241 Dacalc.
LogP (octanol/water)
3.7calc.
Topological polar surface area
80.83 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
9calc.
Heavy atoms
34calc.
Rings
4calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.42calc.
Formal charge
0calc.
Stereocentres
1calc.
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=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc2ccccc2[nH]1

O=C(NCCCCN1CCN(c2ccccc2)CC1)c1cc2ccccc2[nH]1

4 rings, 28 atoms.

2 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.

Orb3174644 suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

No supplier listings yet

Post one free request and suppliers who make or trade Orb3174644 can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

Orb3174644 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.

Get latest price

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 Orb3174644 is traded under.

HS 2933.59Indicative HS code

Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring, other

World exports in 2024
$18.4B
+10.5% vs 2023, imports $24.8B
2019 to 2024
Top exporters
  1. Ireland43.6%
  2. Switzerland * partner reported26.3%
  3. China7.9%
Top importers
  1. Slovenia30.3%
  2. United States30.1%
  3. Germany15.3%

* Partner reported figures, a lower bound.

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

The HS code shown for Orb3174644 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb3174644, based on the data on this page

What is Orb3174644?

Orb3174644 is a chemical substance with the molecular formula C26H33ClN4O3 and a molar mass of 485.03 g/mol. Its CAS registry number is 1982347-43-2. The IUPAC name is N-[4-[4-(3-chloro-5-ethyl-2-methoxyphenyl)piperazin-1-yl]-3-hydroxybutyl]-1H-indole-2-carboxamide.

What is the CAS number of Orb3174644?

The CAS registry number of Orb3174644 is 1982347-43-2.

What is the molecular formula and weight of Orb3174644?

The molecular formula of Orb3174644 is C26H33ClN4O3 and its molar mass is 485.03 g/mol.

What is Orb3174644 used for?

Known uses and roles of Orb3174644 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Orb3174644 hazardous?

No GHS hazard classification for Orb3174644 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 Orb3174644?

Orb3174644 is usually classified under HS code 293359 (Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Orb3174644?

Post a free request on CompoundList and suppliers of Orb3174644 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb3174644?

Suppliers quote Orb3174644 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 Orb3174644

Get quotes for Orb3174644

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell Orb3174644
Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
Embed this structure on your websiteShow code

Paste this code into your page to show the 2D structure of Orb3174644 with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/orb3174644-1982347-43-2" title="Orb3174644 structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>
Preview the embed

Explore more in Screening compounds or HS code 293359

Price on request
Free quotes, contact stays private
Get quotes