F177-0954 Screening compound: 2-(4-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]benzoyl}piperazin-1-yl)pyrimidine

F177-0954 Screening compound: 2-(4-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]benzoyl}piperazin-1-yl)pyrimidine
F177-0954 Screening compound: 2-(4-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]benzoyl}piperazin-1-yl)pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound F177-0954
2-(4-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]benzoyl}piperazin-1-yl)pyrimidine

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

F177-0954

Molecular Formula

C23H19ClN6O2 (C23 H19 ClN6 O2)

Compound Name

2-(4-{2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]benzoyl}piperazin-1-yl)pyrimidine

IUPAC name

2-(4-{2-[3-(4-chlorophenyl)-124-oxadiazol-5-yl]benzoyl}piperazin-1-yl)pyrimidine

SMILES

O=C(c(cccc1)c1-c1nc(-c(cc2)ccc2Cl)no1)N(CC1)CCN1c1ncccn1

InChI

InChI=1S/C23H19ClN6O2/c24-17-8-6-16(7-9-17)20-27-21(32-28-20)18-4-1-2-5-19(18)22(31)29-12-14-30(15-13-29)23-25-10-3-11-26-23/h1-11H,12-15H2

InChI Key

RSNJPSHEDDXKDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27107079

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.9

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.543

Distribution Coefficient, logD

4.543

Water Solubility, LogSw

-4.91

Polar Surface Area

69.915

Acid Dissociation Constant (pKa)

21.00

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

F177-0954 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

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

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F177-0954 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F177-0954?
Check Price and Availability of F177-0954, 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 F177-0954 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F177-0954
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F177-0954
  • 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 F177-0954 available by request