Y040-9407 Screening compound: N-(3,3-diphenylpropyl)-5-{[4-(trifluoromethoxy)phenoxy]methyl}furan-2-carboxamide

Y040-9407 Screening compound: N-(3,3-diphenylpropyl)-5-{[4-(trifluoromethoxy)phenoxy]methyl}furan-2-carboxamide
Y040-9407 Screening compound: N-(3,3-diphenylpropyl)-5-{[4-(trifluoromethoxy)phenoxy]methyl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-9407
N-(3,3-diphenylpropyl)-5-{[4-(trifluoromethoxy)phenoxy]methyl}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

Y040-9407

Molecular Formula

C28H24F3NO4 (C28 H24 F3 NO4)

Compound Name

N-(3,3-diphenylpropyl)-5-{[4-(trifluoromethoxy)phenoxy]methyl}furan-2-carboxamide

IUPAC name

N-(33-diphenylpropyl)-5-{[4-(trifluoromethoxy)phenoxy]methyl}furan-2-carboxamide

SMILES

O=C(c1ccc(COc(cc2)ccc2OC(F)(F)F)o1)NCCC(c1ccccc1)c1ccccc1

InChI

InChI=1S/C28H24F3NO4/c29-28(30,31)36-23-13-11-22(12-14-23)34-19-24-15-16-26(35-24)27(33)32-18-17-25(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-16,25H,17-19H2,(H,32,33)

InChI Key

OOMJOYKYGRVWPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16623456

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.020

Distribution Coefficient, logD

7.020

Water Solubility, LogSw

-6.10

Polar Surface Area

45.227

Acid Dissociation Constant (pKa)

13.27

Base Dissociation Constant (pKb)

-2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.90

Y040-9407 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Y040-9407 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-9407?
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What is the minimum amount of Y040-9407 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-9407
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-9407
  • 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 Y040-9407 available by request