0344-0053 Screening compound: 3-chloro-5-acetamidobenzoic acid

0344-0053 Screening compound: 3-chloro-5-acetamidobenzoic acid
0344-0053 Screening compound: 3-chloro-5-acetamidobenzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0344-0053
3-chloro-5-acetamidobenzoic 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

0344-0053

Molecular Formula

C9H8ClNO3 (C9 H8 ClNO3)

Compound Name

3-chloro-5-acetamidobenzoic acid

IUPAC name

3-chloro-5-acetamidobenzoic acid

SMILES

CC(Nc1cc(C(O)=O)cc(Cl)c1)=O

InChI

InChI=1S/C9H8ClNO3/c1-5(12)11-8-3-6(9(13)14)2-7(10)4-8/h2-4H,1H3,(H,11,12)(H,13,14)

InChI Key

BLAONQGKTJKXTD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00985248

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

213.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.200

Distribution Coefficient, logD

-0.951

Water Solubility, LogSw

-2.84

Polar Surface Area

51.908

Acid Dissociation Constant (pKa)

4.25

Base Dissociation Constant (pKb)

-2.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

0344-0053 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 0344-0053 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0344-0053?
Check Price and Availability of 0344-0053, 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 0344-0053 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0344-0053
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0344-0053
  • 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 0344-0053 available by request