Y503-2295 Screening compound: 5-[(4-bromo-2-chlorophenoxy)methyl]-2-furoic acid

Y503-2295 Screening compound: 5-[(4-bromo-2-chlorophenoxy)methyl]-2-furoic acid
Y503-2295 Screening compound: 5-[(4-bromo-2-chlorophenoxy)methyl]-2-furoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y503-2295
5-[(4-bromo-2-chlorophenoxy)methyl]-2-furoic 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

Y503-2295

Molecular Formula

C12H8BrClO4 (C12 H8 BrClO4)

Compound Name

5-[(4-bromo-2-chlorophenoxy)methyl]-2-furoic acid

IUPAC name

5-[(4-bromo-2-chlorophenoxy)methyl]furan-2-carboxylic acid

SMILES

OC(c1ccc(COc(ccc(Br)c2)c2Cl)o1)=O

InChI

InChI=1S/C12H8BrClO4/c13-7-1-3-10(9(14)5-7)17-6-8-2-4-11(18-8)12(15)16/h1-5H,6H2,(H,15,16)

InChI Key

GMUGPBYRNBSZIP-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.430

Distribution Coefficient, logD

-0.554

Water Solubility, LogSw

-3.27

Polar Surface Area

43.802

Acid Dissociation Constant (pKa)

3.42

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.33

Y503-2295 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y503-2295 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y503-2295?
Check Price and Availability of Y503-2295, 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 Y503-2295 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y503-2295
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y503-2295
  • 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 Y503-2295 available by request