6948-4494 Screening compound: 1-benzyl-3-cyclohexanecarbonyl-1H-indole

6948-4494 Screening compound: 1-benzyl-3-cyclohexanecarbonyl-1H-indole
6948-4494 Screening compound: 1-benzyl-3-cyclohexanecarbonyl-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound 6948-4494
1-benzyl-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

6948-4494

Molecular Formula

C22H23NO (C22 H23 NO)

Compound Name

1-benzyl-3-cyclohexanecarbonyl-1H-indole

IUPAC name

1-benzyl-3-cyclohexanecarbonyl-1H-indole

SMILES

O=C(C1CCCCC1)c1cn(Cc2ccccc2)c2c1cccc2

InChI

InChI=1S/C22H23NO/c24-22(18-11-5-2-6-12-18)20-16-23(15-17-9-3-1-4-10-17)21-14-8-7-13-19(20)21/h1,3-4,7-10,13-14,16,18H,2,5-6,11-12,15H2

InChI Key

LLLOFGDAOURYIJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04403212

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.43

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.497

Distribution Coefficient, logD

5.497

Water Solubility, LogSw

-5.79

Polar Surface Area

15.630

Acid Dissociation Constant (pKa)

20.03

Base Dissociation Constant (pKb)

-3.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

6948-4494 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Proteases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6948-4494 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6948-4494?
Check Price and Availability of 6948-4494, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6948-4494 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6948-4494
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6948-4494
  • 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 6948-4494 available by request