7397-0113 Screening compound: N-{3-[2-(3,5-dimethylphenoxy)acetamido]-4-methoxyphenyl}furan-2-carboxamide

7397-0113 Screening compound: N-{3-[2-(3,5-dimethylphenoxy)acetamido]-4-methoxyphenyl}furan-2-carboxamide
7397-0113 Screening compound: N-{3-[2-(3,5-dimethylphenoxy)acetamido]-4-methoxyphenyl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7397-0113
N-{3-[2-(3,5-dimethylphenoxy)acetamido]-4-methoxyphenyl}furan-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

7397-0113

Molecular Formula

C22H22N2O5 (C22 H22 N2 O5)

Compound Name

N-{3-[2-(3,5-dimethylphenoxy)acetamido]-4-methoxyphenyl}furan-2-carboxamide

IUPAC name

N-{3-[2-(35-dimethylphenoxy)acetamido]-4-methoxyphenyl}furan-2-carboxamide

SMILES

Cc1cc(OCC(Nc(cc(cc2)NC(c3ccco3)=O)c2OC)=O)cc(C)c1

InChI

InChI=1S/C22H22N2O5/c1-14-9-15(2)11-17(10-14)29-13-21(25)24-18-12-16(6-7-19(18)27-3)23-22(26)20-5-4-8-28-20/h4-12H,13H2,1-3H3,(H,23,26)(H,24,25)

InChI Key

NGLLDNFCKIJSLB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04401894

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.797

Distribution Coefficient, logD

3.797

Water Solubility, LogSw

-4.03

Polar Surface Area

69.218

Acid Dissociation Constant (pKa)

11.17

Base Dissociation Constant (pKb)

1.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

7397-0113 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anticancer Library (62698 compounds)

Human Receptors Annotated Library (5376 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

References: we are preparing a list of scientific research reports with 7397-0113 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7397-0113?
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What is the minimum amount of 7397-0113 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7397-0113
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7397-0113
  • 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 7397-0113 available by request