C201-1986 Screening compound: 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethanethioamide

C201-1986 Screening compound: 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethanethioamide
C201-1986 Screening compound: 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethanethioamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-1986
2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethanethioamide

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

C201-1986

Molecular Formula

C10H8ClN3OS (C10 H8 ClN3 OS)

Compound Name

2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethanethioamide

IUPAC name

2-[3-(4-chlorophenyl)-124-oxadiazol-5-yl]ethanethioamide

SMILES

NC(Cc1nc(-c(cc2)ccc2Cl)no1)=S

InChI

InChI=1S/C10H8ClN3OS/c11-7-3-1-6(2-4-7)10-13-9(15-14-10)5-8(12)16/h1-4H,5H2,(H2,12,16)

InChI Key

CJBSPJJSLFTBHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729852

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

253.71

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

2.874

Distribution Coefficient, logD

2.874

Water Solubility, LogSw

-3.57

Polar Surface Area

50.855

Acid Dissociation Constant (pKa)

13.57

Base Dissociation Constant (pKb)

1.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

C201-1986 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Proteases
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C201-1986 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-1986?
Check Price and Availability of C201-1986, 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 C201-1986 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-1986
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-1986
  • 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 C201-1986 available by request