2922-2813 Screening compound: 2-methyl-3-(thiophene-2-amido)benzoic acid

2922-2813 Screening compound: 2-methyl-3-(thiophene-2-amido)benzoic acid
2922-2813 Screening compound: 2-methyl-3-(thiophene-2-amido)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 2922-2813
2-methyl-3-(thiophene-2-amido)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

2922-2813

Molecular Formula

C13H11NO3S (C13 H11 NO3 S)

Compound Name

2-methyl-3-(thiophene-2-amido)benzoic acid

IUPAC name

2-methyl-3-(thiophene-2-amido)benzoic acid

SMILES

Cc(c(C(O)=O)ccc1)c1NC(c1cccs1)=O

InChI

InChI=1S/C13H11NO3S/c1-8-9(13(16)17)4-2-5-10(8)14-12(15)11-6-3-7-18-11/h2-7H,1H3,(H,14,15)(H,16,17)

InChI Key

FWTAWISRDLCVFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01158918

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

261.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.913

Distribution Coefficient, logD

0.050

Water Solubility, LogSw

-3.50

Polar Surface Area

52.058

Acid Dissociation Constant (pKa)

4.54

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

2922-2813 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Fragments Library (11262 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 2922-2813 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2922-2813?
Check Price and Availability of 2922-2813, 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 2922-2813 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2922-2813
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2922-2813
  • 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 2922-2813 available by request