7397-0080 Screening compound: N-[3-(3,4-dimethylbenzamido)-4-methoxyphenyl]furan-2-carboxamide

7397-0080 Screening compound: N-[3-(3,4-dimethylbenzamido)-4-methoxyphenyl]furan-2-carboxamide
7397-0080 Screening compound: N-[3-(3,4-dimethylbenzamido)-4-methoxyphenyl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7397-0080
N-[3-(3,4-dimethylbenzamido)-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

7397-0080

Molecular Formula

C21H20N2O4 (C21 H20 N2 O4)

Compound Name

N-[3-(3,4-dimethylbenzamido)-4-methoxyphenyl]furan-2-carboxamide

IUPAC name

N-[3-(34-dimethylbenzamido)-4-methoxyphenyl]furan-2-carboxamide

SMILES

Cc(cc1)c(C)cc1C(Nc(cc(cc1)NC(c2ccco2)=O)c1OC)=O

InChI

InChI=1S/C21H20N2O4/c1-13-6-7-15(11-14(13)2)20(24)23-17-12-16(8-9-18(17)26-3)22-21(25)19-5-4-10-27-19/h4-12H,1-3H3,(H,22,25)(H,23,24)

InChI Key

PWSOWLVLAZLDAO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04401551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.4

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

4.064

Distribution Coefficient, logD

4.055

Water Solubility, LogSw

-4.15

Polar Surface Area

61.932

Acid Dissociation Constant (pKa)

9.07

Base Dissociation Constant (pKb)

2.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

7397-0080 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human Proteases Annotated Library (2868 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

References: we are preparing a list of scientific research reports with 7397-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7397-0080?
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What is the minimum amount of 7397-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7397-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7397-0080
  • 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 7397-0080 available by request