F624-2898 Screening compound: 8-[1-(4-fluorophenyl)-5-(pyridin-3-yl)-1H-pyrazole-3-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

F624-2898 Screening compound: 8-[1-(4-fluorophenyl)-5-(pyridin-3-yl)-1H-pyrazole-3-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane
F624-2898 Screening compound: 8-[1-(4-fluorophenyl)-5-(pyridin-3-yl)-1H-pyrazole-3-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound F624-2898
8-[1-(4-fluorophenyl)-5-(pyridin-3-yl)-1H-pyrazole-3-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

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

F624-2898

Molecular Formula

C22H21FN4O3 (C22 H21 FN4 O3)

Compound Name

8-[1-(4-fluorophenyl)-5-(pyridin-3-yl)-1H-pyrazole-3-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

IUPAC name

8-[1-(4-fluorophenyl)-5-(pyridin-3-yl)-1H-pyrazole-3-carbonyl]-14-dioxa-8-azaspiro[4.5]decane

SMILES

O=C(c(cc1-c2cnccc2)nn1-c(cc1)ccc1F)N(CC1)CCC11OCCO1

InChI

InChI=1S/C22H21FN4O3/c23-17-3-5-18(6-4-17)27-20(16-2-1-9-24-15-16)14-19(25-27)21(28)26-10-7-22(8-11-26)29-12-13-30-22/h1-6,9,14-15H,7-8,10-13H2

InChI Key

USOHFHHNEXCSOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27179474

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.147

Distribution Coefficient, logD

2.147

Water Solubility, LogSw

-2.11

Polar Surface Area

53.664

Acid Dissociation Constant (pKa)

27.37

Base Dissociation Constant (pKb)

3.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

F624-2898 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

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

Cardiovascular Library (22201 compounds)

Eccentric PPI Library (11937 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Cardiovascular
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Cardiovascular
Targets:
  • Others
  • GPCR
  • Ion Channels
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with F624-2898 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F624-2898?
Check Price and Availability of F624-2898, 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 F624-2898 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F624-2898
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F624-2898
  • 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 F624-2898 available by request