R152-2003 Screening compound: 5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-carboxylic acid

R152-2003 Screening compound: 5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-carboxylic acid
R152-2003 Screening compound: 5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound R152-2003
5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-carboxylic 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

R152-2003

Molecular Formula

C14H14O3S (C14 H14 O3 S)

Compound Name

5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-carboxylic acid

IUPAC name

5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-carboxylic acid

SMILES

Cc1ccc(CSCc2ccc(C(O)=O)o2)cc1

InChI

InChI=1S/C14H14O3S/c1-10-2-4-11(5-3-10)8-18-9-12-6-7-13(17-12)14(15)16/h2-7H,8-9H2,1H3,(H,15,16)

InChI Key

WYLCOKVKQDPXQZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03834532

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

262.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.382

Distribution Coefficient, logD

-0.602

Water Solubility, LogSw

-3.21

Polar Surface Area

36.216

Acid Dissociation Constant (pKa)

3.42

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

R152-2003 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with R152-2003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R152-2003?
Check Price and Availability of R152-2003, 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 R152-2003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R152-2003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R152-2003
  • 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 R152-2003 available by request