F653-0003 Screening compound: N-{4-methyl-2,6-bis[(4-methylphenyl)amino]pyrimidin-5-yl}furan-2-carboxamide

F653-0003 Screening compound: N-{4-methyl-2,6-bis[(4-methylphenyl)amino]pyrimidin-5-yl}furan-2-carboxamide
F653-0003 Screening compound: N-{4-methyl-2,6-bis[(4-methylphenyl)amino]pyrimidin-5-yl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F653-0003
N-{4-methyl-2,6-bis[(4-methylphenyl)amino]pyrimidin-5-yl}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

F653-0003

Molecular Formula

C24H23N5O2 (C24 H23 N5 O2)

Compound Name

N-{4-methyl-2,6-bis[(4-methylphenyl)amino]pyrimidin-5-yl}furan-2-carboxamide

IUPAC name

N-{4-methyl-26-bis[(4-methylphenyl)amino]pyrimidin-5-yl}furan-2-carboxamide

SMILES

Cc(cc1)ccc1Nc(nc(Nc1ccc(C)cc1)nc1C)c1NC(c1ccco1)=O

InChI

InChI=1S/C24H23N5O2/c1-15-6-10-18(11-7-15)26-22-21(28-23(30)20-5-4-14-31-20)17(3)25-24(29-22)27-19-12-8-16(2)9-13-19/h4-14H,1-3H3,(H,28,30)(H2,25,26,27,29)

InChI Key

NPXZROQIAHEQBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14961441

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.163

Distribution Coefficient, logD

4.989

Water Solubility, LogSw

-5.05

Polar Surface Area

69.259

Acid Dissociation Constant (pKa)

9.89

Base Dissociation Constant (pKb)

7.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

F653-0003 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

C-Met Library (15277 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Kinases
  • Proteases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F653-0003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F653-0003?
Check Price and Availability of F653-0003, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F653-0003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F653-0003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F653-0003
  • 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 F653-0003 available by request