4759-7769 Screening compound: 4-(5-{[(4Z)-1-{[(4-fluorophenyl)carbamoyl]methyl}-2,5-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)-3-methylbenzoic acid

4759-7769 Screening compound: 4-(5-{[(4Z)-1-{[(4-fluorophenyl)carbamoyl]methyl}-2,5-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)-3-methylbenzoic acid
4759-7769 Screening compound: 4-(5-{[(4Z)-1-{[(4-fluorophenyl)carbamoyl]methyl}-2,5-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)-3-methylbenzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 4759-7769
4-(5-{[(4Z)-1-{[(4-fluorophenyl)carbamoyl]methyl}-2,5-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)-3-methylbenzoic acid

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

4759-7769

Molecular Formula

C24H18FN3O6 (C24 H18 FN3 O6)

Compound Name

4-(5-{[(4Z)-1-{[(4-fluorophenyl)carbamoyl]methyl}-2,5-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)-3-methylbenzoic acid

IUPAC name

4-(5-{[(4Z)-1-{[(4-fluorophenyl)carbamoyl]methyl}-25-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)-3-methylbenzoic acid

SMILES

Cc(cc(cc1)C(O)=O)c1-c1ccc(/C=C(/C(N2CC(Nc(cc3)ccc3F)=O)=O)\NC2=O)o1

InChI

InChI=1S/C24H18FN3O6/c1-13-10-14(23(31)32)2-8-18(13)20-9-7-17(34-20)11-19-22(30)28(24(33)27-19)12-21(29)26-16-5-3-15(25)4-6-16/h2-11H,12H2,1H3,(H,26,29)(H,27,33)(H,31,32)

InChI Key

FEZPKPJQNSLKEQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05041411

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.42

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.191

Distribution Coefficient, logD

0.956

Water Solubility, LogSw

-4.23

Polar Surface Area

99.798

Acid Dissociation Constant (pKa)

4.17

Base Dissociation Constant (pKb)

-6.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

4759-7769 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 4759-7769 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4759-7769?
Check Price and Availability of 4759-7769, 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 4759-7769 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4759-7769
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4759-7769
  • 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 4759-7769 available by request