4759-7762 Screening compound: 3-methyl-4-(5-{[(4Z)-1-[(4-methylphenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)benzoic acid

4759-7762 Screening compound: 3-methyl-4-(5-{[(4Z)-1-[(4-methylphenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)benzoic acid
4759-7762 Screening compound: 3-methyl-4-(5-{[(4Z)-1-[(4-methylphenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 4759-7762
3-methyl-4-(5-{[(4Z)-1-[(4-methylphenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)benzoic 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

4759-7762

Molecular Formula

C24H20N2O5 (C24 H20 N2 O5)

Compound Name

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

IUPAC name

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

SMILES

Cc1ccc(CN(C(/C(/N2)=C/c3ccc(-c(cc4)c(C)cc4C(O)=O)o3)=O)C2=O)cc1

InChI

InChI=1S/C24H20N2O5/c1-14-3-5-16(6-4-14)13-26-22(27)20(25-24(26)30)12-18-8-10-21(31-18)19-9-7-17(23(28)29)11-15(19)2/h3-12H,13H2,1-2H3,(H,25,30)(H,28,29)

InChI Key

ZOIYLYPNPOHAOV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04012838

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.180

Distribution Coefficient, logD

1.945

Water Solubility, LogSw

-4.70

Polar Surface Area

76.648

Acid Dissociation Constant (pKa)

4.17

Base Dissociation Constant (pKb)

-0.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

4759-7762 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4759-7762 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4759-7762?
Check Price and Availability of 4759-7762, 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 4759-7762 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4759-7762
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4759-7762
  • 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 4759-7762 available by request