5539-0009 Screening compound: N-(2-chlorophenyl)-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide

5539-0009 Screening compound: N-(2-chlorophenyl)-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide
5539-0009 Screening compound: N-(2-chlorophenyl)-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5539-0009
N-(2-chlorophenyl)-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide

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

5539-0009

Molecular Formula

C15H11ClN2O2S (C15 H11 ClN2 O2 S)

Compound Name

N-(2-chlorophenyl)-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide

IUPAC name

N-(2-chlorophenyl)-2-(2-oxo-23-dihydro-13-benzothiazol-3-yl)acetamide

SMILES

O=C(CN(c(cccc1)c1S1)C1=O)Nc(cccc1)c1Cl

InChI

InChI=1S/C15H11ClN2O2S/c16-10-5-1-2-6-11(10)17-14(19)9-18-12-7-3-4-8-13(12)21-15(18)20/h1-8H,9H2,(H,17,19)

InChI Key

FDDKDOHSCLJATL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00796234

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.78

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.149

Distribution Coefficient, logD

3.149

Water Solubility, LogSw

-3.32

Polar Surface Area

38.263

Acid Dissociation Constant (pKa)

10.89

Base Dissociation Constant (pKb)

-0.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

5539-0009 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 5539-0009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5539-0009?
Check Price and Availability of 5539-0009, 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 5539-0009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5539-0009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5539-0009
  • 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 5539-0009 available by request