D337-1868 Screening compound: N-[2-(3-fluoro-4-methylbenzoyl)-1-benzofuran-3-yl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide

D337-1868 Screening compound: N-[2-(3-fluoro-4-methylbenzoyl)-1-benzofuran-3-yl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
D337-1868 Screening compound: N-[2-(3-fluoro-4-methylbenzoyl)-1-benzofuran-3-yl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D337-1868
N-[2-(3-fluoro-4-methylbenzoyl)-1-benzofuran-3-yl]-5-(4-methoxyphenyl)-1,2-oxazole-3-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

D337-1868

Molecular Formula

C27H19FN2O5 (C27 H19 FN2 O5)

Compound Name

N-[2-(3-fluoro-4-methylbenzoyl)-1-benzofuran-3-yl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide

IUPAC name

N-[2-(3-fluoro-4-methylbenzoyl)-1-benzofuran-3-yl]-5-(4-methoxyphenyl)-12-oxazole-3-carboxamide

SMILES

Cc(ccc(C(c(oc1c2cccc1)c2NC(c1noc(-c(cc2)ccc2OC)c1)=O)=O)c1)c1F

InChI

InChI=1S/C27H19FN2O5/c1-15-7-8-17(13-20(15)28)25(31)26-24(19-5-3-4-6-22(19)34-26)29-27(32)21-14-23(35-30-21)16-9-11-18(33-2)12-10-16/h3-14H,1-2H3,(H,29,32)

InChI Key

QMNXLIZDHLXJIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14820482

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.062

Distribution Coefficient, logD

6.060

Water Solubility, LogSw

-5.78

Polar Surface Area

73.006

Acid Dissociation Constant (pKa)

9.81

Base Dissociation Constant (pKb)

-5.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.40

D337-1868 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anticancer Library (62698 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • 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 D337-1868 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D337-1868?
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What is the minimum amount of D337-1868 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D337-1868
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D337-1868
  • 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 D337-1868 available by request