2922-2408 Screening compound: 2-[(4-carboxyphenyl)methyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid

2922-2408 Screening compound: 2-[(4-carboxyphenyl)methyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2922-2408 Screening compound: 2-[(4-carboxyphenyl)methyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 2922-2408
2-[(4-carboxyphenyl)methyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-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

2922-2408

Molecular Formula

C17H11NO6 (C17 H11 NO6)

Compound Name

2-[(4-carboxyphenyl)methyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid

IUPAC name

2-[(4-carboxyphenyl)methyl]-13-dioxo-23-dihydro-1H-isoindole-5-carboxylic acid

SMILES

OC(c1ccc(CN(C(c(cc2)c3cc2C(O)=O)=O)C3=O)cc1)=O

InChI

InChI=1S/C17H11NO6/c19-14-12-6-5-11(17(23)24)7-13(12)15(20)18(14)8-9-1-3-10(4-2-9)16(21)22/h1-7H,8H2,(H,21,22)(H,23,24)

InChI Key

JPBPTBLBYQKZFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01137731

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.28

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.866

Distribution Coefficient, logD

-1.111

Water Solubility, LogSw

-3.16

Polar Surface Area

86.308

Acid Dissociation Constant (pKa)

3.42

Base Dissociation Constant (pKb)

-11.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

2922-2408 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Digestive system
  • Nervous system
Structure:
  • Pool
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 2922-2408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2922-2408?
Check Price and Availability of 2922-2408, 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 2922-2408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2922-2408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2922-2408
  • 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 2922-2408 available by request