C201-1984 Screening compound: 2-[3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethanethioamide

C201-1984 Screening compound: 2-[3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethanethioamide
C201-1984 Screening compound: 2-[3-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethanethioamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-1984
2-[3-(2,4-dimethoxyphenyl)-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

C201-1984

Molecular Formula

C12H13N3O3S (C12 H13 N3 O3 S)

Compound Name

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

IUPAC name

2-[3-(24-dimethoxyphenyl)-124-oxadiazol-5-yl]ethanethioamide

SMILES

COc(cc1)cc(OC)c1-c1noc(CC(N)=S)n1

InChI

InChI=1S/C12H13N3O3S/c1-16-7-3-4-8(9(5-7)17-2)12-14-11(18-15-12)6-10(13)19/h3-5H,6H2,1-2H3,(H2,13,19)

InChI Key

GJAYQZNPCPJNSA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729850

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

279.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.013

Distribution Coefficient, logD

2.013

Water Solubility, LogSw

-2.79

Polar Surface Area

66.029

Acid Dissociation Constant (pKa)

13.57

Base Dissociation Constant (pKb)

1.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C201-1984 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with C201-1984 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-1984?
Check Price and Availability of C201-1984, 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 C201-1984 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-1984
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-1984
  • 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 C201-1984 available by request