2123-0047 Screening compound: N-[3-(2,6-difluorobenzamido)-5-(2-methylphenoxy)phenyl]-2,6-difluorobenzamide

2123-0047 Screening compound: N-[3-(2,6-difluorobenzamido)-5-(2-methylphenoxy)phenyl]-2,6-difluorobenzamide
2123-0047 Screening compound: N-[3-(2,6-difluorobenzamido)-5-(2-methylphenoxy)phenyl]-2,6-difluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2123-0047
N-[3-(2,6-difluorobenzamido)-5-(2-methylphenoxy)phenyl]-2,6-difluorobenzamide

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

2123-0047

Molecular Formula

C27H18F4N2O3 (C27 H18 F4 N2 O3)

Compound Name

N-[3-(2,6-difluorobenzamido)-5-(2-methylphenoxy)phenyl]-2,6-difluorobenzamide

IUPAC name

N-[3-(26-difluorobenzamido)-5-(2-methylphenoxy)phenyl]-26-difluorobenzamide

SMILES

Cc(cccc1)c1Oc1cc(NC(c(c(F)ccc2)c2F)=O)cc(NC(c(c(F)ccc2)c2F)=O)c1

InChI

InChI=1S/C27H18F4N2O3/c1-15-6-2-3-11-23(15)36-18-13-16(32-26(34)24-19(28)7-4-8-20(24)29)12-17(14-18)33-27(35)25-21(30)9-5-10-22(25)31/h2-14H,1H3,(H,32,34)(H,33,35)

InChI Key

VIEINIGWLTVLON-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00291055

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.261

Distribution Coefficient, logD

6.256

Water Solubility, LogSw

-5.64

Polar Surface Area

53.255

Acid Dissociation Constant (pKa)

9.33

Base Dissociation Constant (pKb)

-4.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.70

References: we are preparing a list of scientific research reports with 2123-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2123-0047?
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What is the minimum amount of 2123-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2123-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2123-0047
  • 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 2123-0047 available by request