R052-1920 Screening compound: 2,3-dihydro-1,4-benzodioxine-2-carboxylic acid

R052-1920 Screening compound: 2,3-dihydro-1,4-benzodioxine-2-carboxylic acid
R052-1920 Screening compound: 2,3-dihydro-1,4-benzodioxine-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound R052-1920
2,3-dihydro-1,4-benzodioxine-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

R052-1920

Molecular Formula

C9H8O4 (C9 H8 O4)

Compound Name

2,3-dihydro-1,4-benzodioxine-2-carboxylic acid

IUPAC name

23-dihydro-14-benzodioxine-2-carboxylic acid

SMILES

OC(C1Oc(cccc2)c2OC1)=O

InChI

InChI=1S/C9H8O4/c10-9(11)8-5-12-6-3-1-2-4-7(6)13-8/h1-4,8H,5H2,(H,10,11)/t8-/m0/s1

InChI Key

HMBHAQMOBKLWRX-QMMMGPOBSA-N

MDL Number (MFCD)

MFCD00084888

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

180.16

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.174

Distribution Coefficient, logD

-2.636

Water Solubility, LogSw

-1.52

Polar Surface Area

44.084

Acid Dissociation Constant (pKa)

3.59

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

R052-1920 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

Akt-Targeted Library (14764 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Structure:
  • Fragments
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with R052-1920 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R052-1920?
Check Price and Availability of R052-1920, 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 R052-1920 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R052-1920
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R052-1920
  • 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 R052-1920 available by request