D038-0734 Screening compound: 3-[2-(4,6-dimethyl-1-benzofuran-3-yl)acetamido]-N-(3-methylphenyl)-1-benzofuran-2-carboxamide

D038-0734 Screening compound: 3-[2-(4,6-dimethyl-1-benzofuran-3-yl)acetamido]-N-(3-methylphenyl)-1-benzofuran-2-carboxamide
D038-0734 Screening compound: 3-[2-(4,6-dimethyl-1-benzofuran-3-yl)acetamido]-N-(3-methylphenyl)-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D038-0734
3-[2-(4,6-dimethyl-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

D038-0734

Molecular Formula

C28H24N2O4 (C28 H24 N2 O4)

Compound Name

3-[2-(4,6-dimethyl-1-benzofuran-3-yl)acetamido]-N-(3-methylphenyl)-1-benzofuran-2-carboxamide

IUPAC name

3-[2-(46-dimethyl-1-benzofuran-3-yl)acetamido]-N-(3-methylphenyl)-1-benzofuran-2-carboxamide

SMILES

Cc1cccc(NC(c(oc2c3cccc2)c3NC(Cc2coc3cc(C)cc(C)c23)=O)=O)c1

InChI

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

InChI Key

NUOORINYTBOWMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06646094

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

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.992

Distribution Coefficient, logD

5.990

Water Solubility, LogSw

-6.08

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

D038-0734 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • 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 D038-0734 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D038-0734?
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What is the minimum amount of D038-0734 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D038-0734
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D038-0734
  • 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 D038-0734 available by request