F538-0813 Screening compound: 3-{3-[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}-1-phenylurea

F538-0813 Screening compound: 3-{3-[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}-1-phenylurea
F538-0813 Screening compound: 3-{3-[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}-1-phenylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound F538-0813
3-{3-[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}-1-phenylurea

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

F538-0813

Molecular Formula

C21H15ClN4O2 (C21 H15 ClN4 O2)

Compound Name

3-{3-[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl}-1-phenylurea

IUPAC name

3-{3-[5-(4-chlorophenyl)-124-oxadiazol-3-yl]phenyl}-1-phenylurea

SMILES

O=C(Nc1ccccc1)Nc1cccc(-c2noc(-c(cc3)ccc3Cl)n2)c1

InChI

InChI=1S/C21H15ClN4O2/c22-16-11-9-14(10-12-16)20-25-19(26-28-20)15-5-4-8-18(13-15)24-21(27)23-17-6-2-1-3-7-17/h1-13H,(H2,23,24,27)

InChI Key

TXQHQYYNDRAULU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27173944

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.396

Distribution Coefficient, logD

6.396

Water Solubility, LogSw

-6.54

Polar Surface Area

63.947

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

0.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

F538-0813 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with F538-0813 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F538-0813?
Check Price and Availability of F538-0813, 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 F538-0813 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F538-0813
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F538-0813
  • 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 F538-0813 available by request