6948-4484 Screening compound: 1-[2-(4-chlorophenoxy)ethyl]-3-cyclohexanecarbonyl-1H-indole

6948-4484 Screening compound: 1-[2-(4-chlorophenoxy)ethyl]-3-cyclohexanecarbonyl-1H-indole
6948-4484 Screening compound: 1-[2-(4-chlorophenoxy)ethyl]-3-cyclohexanecarbonyl-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound 6948-4484
1-[2-(4-chlorophenoxy)ethyl]-3-cyclohexanecarbonyl-1H-indole

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

6948-4484

Molecular Formula

C23H24ClNO2 (C23 H24 ClNO2)

Compound Name

1-[2-(4-chlorophenoxy)ethyl]-3-cyclohexanecarbonyl-1H-indole

IUPAC name

1-[2-(4-chlorophenoxy)ethyl]-3-cyclohexanecarbonyl-1H-indole

SMILES

O=C(C1CCCCC1)c1cn(CCOc(cc2)ccc2Cl)c2c1cccc2

InChI

InChI=1S/C23H24ClNO2/c24-18-10-12-19(13-11-18)27-15-14-25-16-21(20-8-4-5-9-22(20)25)23(26)17-6-2-1-3-7-17/h4-5,8-13,16-17H,1-3,6-7,14-15H2

InChI Key

YWDUKJCXOWKMPT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04387245

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.9

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.299

Distribution Coefficient, logD

6.299

Water Solubility, LogSw

-6.32

Polar Surface Area

23.026

Acid Dissociation Constant (pKa)

20.03

Base Dissociation Constant (pKb)

-2.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

6948-4484 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 6948-4484 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6948-4484?
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What is the minimum amount of 6948-4484 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6948-4484
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6948-4484
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 6948-4484 available by request