6861-0066 Screening compound: 4-chloro-N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]benzamide

6861-0066 Screening compound: 4-chloro-N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]benzamide
6861-0066 Screening compound: 4-chloro-N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6861-0066
4-chloro-N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]benzamide

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

6861-0066

Molecular Formula

C23H16ClNO3 (C23 H16 ClNO3)

Compound Name

4-chloro-N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]benzamide

IUPAC name

4-chloro-N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]benzamide

SMILES

Cc(cc1)ccc1C(c(oc1c2cccc1)c2NC(c(cc1)ccc1Cl)=O)=O

InChI

InChI=1S/C23H16ClNO3/c1-14-6-8-15(9-7-14)21(26)22-20(18-4-2-3-5-19(18)28-22)25-23(27)16-10-12-17(24)13-11-16/h2-13H,1H3,(H,25,27)

InChI Key

QCROMOJSDANVJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06319852

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.84

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.565

Distribution Coefficient, logD

5.327

Water Solubility, LogSw

-6.13

Polar Surface Area

43.927

Acid Dissociation Constant (pKa)

7.54

Base Dissociation Constant (pKb)

-4.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

6861-0066 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6861-0066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6861-0066?
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What is the minimum amount of 6861-0066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6861-0066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6861-0066
  • 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 6861-0066 available by request