2922-2801 Screening compound: 3-[5-(4-carboxybenzenesulfonyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl]-4-methylbenzoic acid

2922-2801 Screening compound: 3-[5-(4-carboxybenzenesulfonyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl]-4-methylbenzoic acid
2922-2801 Screening compound: 3-[5-(4-carboxybenzenesulfonyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl]-4-methylbenzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 2922-2801
3-[5-(4-carboxybenzenesulfonyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl]-4-methylbenzoic 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

2922-2801

Molecular Formula

C23H15NO8S (C23 H15 NO8 S)

Compound Name

3-[5-(4-carboxybenzenesulfonyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl]-4-methylbenzoic acid

IUPAC name

3-[5-(4-carboxybenzenesulfonyl)-13-dioxo-23-dihydro-1H-isoindol-2-yl]-4-methylbenzoic acid

SMILES

Cc(ccc(C(O)=O)c1)c1N(C(c(cc1)c2cc1S(c(cc1)ccc1C(O)=O)(=O)=O)=O)C2=O

InChI

InChI=1S/C23H15NO8S/c1-12-2-3-14(23(29)30)10-19(12)24-20(25)17-9-8-16(11-18(17)21(24)26)33(31,32)15-6-4-13(5-7-15)22(27)28/h2-11H,1H3,(H,27,28)(H,29,30)

InChI Key

PFVAWNLYXCMZJK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01158902

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.44

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.193

Distribution Coefficient, logD

1.135

Water Solubility, LogSw

-4.19

Polar Surface Area

114.896

Acid Dissociation Constant (pKa)

4.34

Base Dissociation Constant (pKb)

-8.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

References: we are preparing a list of scientific research reports with 2922-2801 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2922-2801?
Check Price and Availability of 2922-2801, 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 2922-2801 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2922-2801
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2922-2801
  • 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 2922-2801 available by request