F532-0797 Screening compound: 3-(4-{5-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)-1-phenylurea

F532-0797 Screening compound: 3-(4-{5-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)-1-phenylurea
F532-0797 Screening compound: 3-(4-{5-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)-1-phenylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound F532-0797
3-(4-{5-[(4-methoxyphenyl)methyl]-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

F532-0797

Molecular Formula

C23H20N4O3 (C23 H20 N4 O3)

Compound Name

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

IUPAC name

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

SMILES

COc1ccc(Cc2nc(-c(cc3)ccc3NC(Nc3ccccc3)=O)no2)cc1

InChI

InChI=1S/C23H20N4O3/c1-29-20-13-7-16(8-14-20)15-21-26-22(27-30-21)17-9-11-19(12-10-17)25-23(28)24-18-5-3-2-4-6-18/h2-14H,15H2,1H3,(H2,24,25,28)

InChI Key

JVTFLYKJWYNKKV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27173034

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.494

Distribution Coefficient, logD

5.494

Water Solubility, LogSw

-5.53

Polar Surface Area

71.157

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

-0.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

F532-0797 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with F532-0797 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F532-0797?
Check Price and Availability of F532-0797, 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 F532-0797 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F532-0797
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F532-0797
  • 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 F532-0797 available by request