F543-0722 Screening compound: 1-cyclopentyl-5-{5-[(1E)-2-(thiophen-2-yl)ethenyl]-1,2,4-oxadiazol-3-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one

F543-0722 Screening compound: 1-cyclopentyl-5-{5-[(1E)-2-(thiophen-2-yl)ethenyl]-1,2,4-oxadiazol-3-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one
F543-0722 Screening compound: 1-cyclopentyl-5-{5-[(1E)-2-(thiophen-2-yl)ethenyl]-1,2,4-oxadiazol-3-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F543-0722
1-cyclopentyl-5-{5-[(1E)-2-(thiophen-2-yl)ethenyl]-1,2,4-oxadiazol-3-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one

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

F543-0722

Molecular Formula

C20H18N4O2S (C20 H18 N4 O2 S)

Compound Name

1-cyclopentyl-5-{5-[(1E)-2-(thiophen-2-yl)ethenyl]-1,2,4-oxadiazol-3-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one

IUPAC name

1-cyclopentyl-5-{5-[(1E)-2-(thiophen-2-yl)ethenyl]-124-oxadiazol-3-yl}-23-dihydro-1H-13-benzodiazol-2-one

SMILES

O=C1N(C2CCCC2)c(ccc(-c2noc(/C=C/c3cccs3)n2)c2)c2N1

InChI

InChI=1S/C20H18N4O2S/c25-20-21-16-12-13(7-9-17(16)24(20)14-4-1-2-5-14)19-22-18(26-23-19)10-8-15-6-3-11-27-15/h3,6-12,14H,1-2,4-5H2,(H,21,25)

InChI Key

JVFFPNPRPBSONM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27175341

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.596

Distribution Coefficient, logD

5.596

Water Solubility, LogSw

-5.81

Polar Surface Area

58.739

Acid Dissociation Constant (pKa)

14.26

Base Dissociation Constant (pKb)

-1.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

F543-0722 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Hsp90-Targeted Library (11355 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with F543-0722 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F543-0722?
Check Price and Availability of F543-0722, 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 F543-0722 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F543-0722
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F543-0722
  • 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 F543-0722 available by request