F531-0968 Screening compound: 1-{4-[4-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)phenyl]piperazin-1-yl}-2-(3,5-dimethoxyphenyl)ethan-1-one

F531-0968 Screening compound: 1-{4-[4-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)phenyl]piperazin-1-yl}-2-(3,5-dimethoxyphenyl)ethan-1-one
F531-0968 Screening compound: 1-{4-[4-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)phenyl]piperazin-1-yl}-2-(3,5-dimethoxyphenyl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F531-0968
1-{4-[4-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)phenyl]piperazin-1-yl}-2-(3,5-dimethoxyphenyl)ethan-1-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

F531-0968

Molecular Formula

C26H30N4O4 (C26 H30 N4 O4)

Compound Name

1-{4-[4-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)phenyl]piperazin-1-yl}-2-(3,5-dimethoxyphenyl)ethan-1-one

IUPAC name

1-{4-[4-(5-cyclobutyl-124-oxadiazol-3-yl)phenyl]piperazin-1-yl}-2-(35-dimethoxyphenyl)ethan-1-one

SMILES

COc1cc(CC(N(CC2)CCN2c(cc2)ccc2-c2noc(C3CCC3)n2)=O)cc(OC)c1

InChI

InChI=1S/C26H30N4O4/c1-32-22-14-18(15-23(17-22)33-2)16-24(31)30-12-10-29(11-13-30)21-8-6-19(7-9-21)25-27-26(34-28-25)20-4-3-5-20/h6-9,14-15,17,20H,3-5,10-13,16H2,1-2H3

InChI Key

NGWJFJDEOVLGQU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27172914

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.535

Distribution Coefficient, logD

4.535

Water Solubility, LogSw

-4.34

Polar Surface Area

66.636

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.30

References: we are preparing a list of scientific research reports with F531-0968 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F531-0968?
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What is the minimum amount of F531-0968 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F531-0968
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F531-0968
  • 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 F531-0968 available by request