2372-3629 Screening compound: 5-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamido]benzene-1,3-dicarboxylic acid

2372-3629 Screening compound: 5-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamido]benzene-1,3-dicarboxylic acid
2372-3629 Screening compound: 5-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamido]benzene-1,3-dicarboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 2372-3629
5-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamido]benzene-1,3-dicarboxylic 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

2372-3629

Molecular Formula

C18H12N2O7 (C18 H12 N2 O7)

Compound Name

5-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamido]benzene-1,3-dicarboxylic acid

IUPAC name

5-[2-(13-dioxo-23-dihydro-1H-isoindol-2-yl)acetamido]benzene-13-dicarboxylic acid

SMILES

OC(c1cc(NC(CN(C(c2c3cccc2)=O)C3=O)=O)cc(C(O)=O)c1)=O

InChI

InChI=1S/C18H12N2O7/c21-14(8-20-15(22)12-3-1-2-4-13(12)16(20)23)19-11-6-9(17(24)25)5-10(7-11)18(26)27/h1-7H,8H2,(H,19,21)(H,24,25)(H,26,27)

InChI Key

JBUPMMZALFLJOJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00827190

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.3

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.471

Distribution Coefficient, logD

-0.893

Water Solubility, LogSw

-2.98

Polar Surface Area

109.457

Acid Dissociation Constant (pKa)

3.77

Base Dissociation Constant (pKb)

-2.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

2372-3629 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 2372-3629 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2372-3629?
Check Price and Availability of 2372-3629, 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 2372-3629 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2372-3629
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2372-3629
  • 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 2372-3629 available by request