D038-0626 Screening compound: 3-[2-(5-ethyl-1-benzofuran-3-yl)acetamido]-N-(3-methylphenyl)-1-benzofuran-2-carboxamide

D038-0626 Screening compound: 3-[2-(5-ethyl-1-benzofuran-3-yl)acetamido]-N-(3-methylphenyl)-1-benzofuran-2-carboxamide
D038-0626 Screening compound: 3-[2-(5-ethyl-1-benzofuran-3-yl)acetamido]-N-(3-methylphenyl)-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D038-0626
3-[2-(5-ethyl-1-benzofuran-3-yl)acetamido]-N-(3-methylphenyl)-1-benzofuran-2-carboxamide

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

D038-0626

Molecular Formula

C28H24N2O4 (C28 H24 N2 O4)

Compound Name

3-[2-(5-ethyl-1-benzofuran-3-yl)acetamido]-N-(3-methylphenyl)-1-benzofuran-2-carboxamide

IUPAC name

3-[2-(5-ethyl-1-benzofuran-3-yl)acetamido]-N-(3-methylphenyl)-1-benzofuran-2-carboxamide

SMILES

CCc(cc1)cc2c1occ2CC(Nc1c(C(Nc2cc(C)ccc2)=O)oc2c1cccc2)=O

InChI

InChI=1S/C28H24N2O4/c1-3-18-11-12-23-22(14-18)19(16-33-23)15-25(31)30-26-21-9-4-5-10-24(21)34-27(26)28(32)29-20-8-6-7-17(2)13-20/h4-14,16H,3,15H2,1-2H3,(H,29,32)(H,30,31)

InChI Key

LWVVCSWAMQKLNY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06646348

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.914

Distribution Coefficient, logD

5.912

Water Solubility, LogSw

-5.77

Polar Surface Area

62.897

Acid Dissociation Constant (pKa)

9.75

Base Dissociation Constant (pKb)

-0.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

D038-0626 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D038-0626 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D038-0626?
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What is the minimum amount of D038-0626 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D038-0626
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D038-0626
  • 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 D038-0626 available by request