4228-1010 Screening compound: 2-{2-chloro-4-[(1,3-dioxo-2,3-dihydro-1H-inden-2-ylidene)methyl]phenoxy}acetic acid

4228-1010 Screening compound: 2-{2-chloro-4-[(1,3-dioxo-2,3-dihydro-1H-inden-2-ylidene)methyl]phenoxy}acetic acid
4228-1010 Screening compound: 2-{2-chloro-4-[(1,3-dioxo-2,3-dihydro-1H-inden-2-ylidene)methyl]phenoxy}acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 4228-1010
2-{2-chloro-4-[(1,3-dioxo-2,3-dihydro-1H-inden-2-ylidene)methyl]phenoxy}acetic 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

4228-1010

Molecular Formula

C18H11ClO5 (C18 H11 ClO5)

Compound Name

2-{2-chloro-4-[(1,3-dioxo-2,3-dihydro-1H-inden-2-ylidene)methyl]phenoxy}acetic acid

IUPAC name

2-{2-chloro-4-[(13-dioxo-23-dihydro-1H-inden-2-ylidene)methyl]phenoxy}acetic acid

SMILES

OC(COc(ccc(C=C(C(c1c2cccc1)=O)C2=O)c1)c1Cl)=O

InChI

InChI=1S/C18H11ClO5/c19-14-8-10(5-6-15(14)24-9-16(20)21)7-13-17(22)11-3-1-2-4-12(11)18(13)23/h1-8H,9H2,(H,20,21)

InChI Key

OFYSZHOWCKXAQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02615110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.74

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.260

Distribution Coefficient, logD

-0.977

Water Solubility, LogSw

-3.53

Polar Surface Area

62.516

Acid Dissociation Constant (pKa)

3.16

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

4228-1010 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 4228-1010 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4228-1010?
Check Price and Availability of 4228-1010, 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 4228-1010 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4228-1010
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4228-1010
  • 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 4228-1010 available by request