0242-0576 Screening compound: 2-(4-methylbenzenesulfonamido)acetic acid

0242-0576 Screening compound: 2-(4-methylbenzenesulfonamido)acetic acid
0242-0576 Screening compound: 2-(4-methylbenzenesulfonamido)acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0242-0576
2-(4-methylbenzenesulfonamido)acetic 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

0242-0576

Molecular Formula

C9H11NO4S (C9 H11 NO4 S)

Compound Name

2-(4-methylbenzenesulfonamido)acetic acid

IUPAC name

2-(4-methylbenzenesulfonamido)acetic acid

SMILES

Cc(cc1)ccc1S(NCC(O)=O)(=O)=O

InChI

InChI=1S/C9H11NO4S/c1-7-2-4-8(5-3-7)15(13,14)10-6-9(11)12/h2-5,10H,6H2,1H3,(H,11,12)

InChI Key

VDKFCCZUCXYILI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00045898

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

229.26

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.548

Distribution Coefficient, logD

-3.483

Water Solubility, LogSw

-2.13

Polar Surface Area

70.652

Acid Dissociation Constant (pKa)

3.37

Base Dissociation Constant (pKb)

-6.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

0242-0576 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 0242-0576 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0242-0576?
Check Price and Availability of 0242-0576, 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 0242-0576 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0242-0576
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0242-0576
  • 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 0242-0576 available by request