2332-0822 Screening compound: 3-(2,4,6-trimethylbenzenesulfonamido)benzoic acid

2332-0822 Screening compound: 3-(2,4,6-trimethylbenzenesulfonamido)benzoic acid
2332-0822 Screening compound: 3-(2,4,6-trimethylbenzenesulfonamido)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 2332-0822
3-(2,4,6-trimethylbenzenesulfonamido)benzoic 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

2332-0822

Molecular Formula

C16H17NO4S (C16 H17 NO4 S)

Compound Name

3-(2,4,6-trimethylbenzenesulfonamido)benzoic acid

IUPAC name

3-(246-trimethylbenzenesulfonamido)benzoic acid

SMILES

Cc(cc1C)cc(C)c1S(Nc1cc(C(O)=O)ccc1)(=O)=O

InChI

InChI=1S/C16H17NO4S/c1-10-7-11(2)15(12(3)8-10)22(20,21)17-14-6-4-5-13(9-14)16(18)19/h4-9,17H,1-3H3,(H,18,19)

InChI Key

MCZDFCRYKVPBEZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00572379

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.489

Distribution Coefficient, logD

1.739

Water Solubility, LogSw

-4.23

Polar Surface Area

69.296

Acid Dissociation Constant (pKa)

4.65

Base Dissociation Constant (pKb)

-11.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

2332-0822 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 2332-0822 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2332-0822?
Check Price and Availability of 2332-0822, 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 2332-0822 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2332-0822
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2332-0822
  • 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 2332-0822 available by request