6861-0550 Screening compound: N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-3-propoxybenzamide

6861-0550 Screening compound: N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-3-propoxybenzamide
6861-0550 Screening compound: N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-3-propoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6861-0550
N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-3-propoxybenzamide

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

6861-0550

Molecular Formula

C26H23NO4 (C26 H23 NO4)

Compound Name

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

IUPAC name

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

SMILES

CCCOc1cccc(C(Nc2c(C(c3ccc(C)cc3)=O)oc3c2cccc3)=O)c1

InChI

InChI=1S/C26H23NO4/c1-3-15-30-20-8-6-7-19(16-20)26(29)27-23-21-9-4-5-10-22(21)31-25(23)24(28)18-13-11-17(2)12-14-18/h4-14,16H,3,15H2,1-2H3,(H,27,29)

InChI Key

AUEHQROEOVJLQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06320205

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.010

Distribution Coefficient, logD

6.001

Water Solubility, LogSw

-5.75

Polar Surface Area

51.345

Acid Dissociation Constant (pKa)

9.09

Base Dissociation Constant (pKb)

-3.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

6861-0550 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 6861-0550 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6861-0550?
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What is the minimum amount of 6861-0550 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6861-0550
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6861-0550
  • 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 6861-0550 available by request