F726-0330 Screening compound: 2-(4-fluorophenyl)-4-[3-(4-methylpiperidine-1-carbonyl)piperidin-1-yl]pyrimidine

F726-0330 Screening compound: 2-(4-fluorophenyl)-4-[3-(4-methylpiperidine-1-carbonyl)piperidin-1-yl]pyrimidine
F726-0330 Screening compound: 2-(4-fluorophenyl)-4-[3-(4-methylpiperidine-1-carbonyl)piperidin-1-yl]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound F726-0330
2-(4-fluorophenyl)-4-[3-(4-methylpiperidine-1-carbonyl)piperidin-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

F726-0330

Molecular Formula

C22H27FN4O (C22 H27 FN4 O)

Compound Name

2-(4-fluorophenyl)-4-[3-(4-methylpiperidine-1-carbonyl)piperidin-1-yl]pyrimidine

IUPAC name

2-(4-fluorophenyl)-4-[3-(4-methylpiperidine-1-carbonyl)piperidin-1-yl]pyrimidine

SMILES

CC(CC1)CCN1C(C(CCC1)CN1c1ccnc(-c(cc2)ccc2F)n1)=O

InChI

InChI=1S/C22H27FN4O/c1-16-9-13-26(14-10-16)22(28)18-3-2-12-27(15-18)20-8-11-24-21(25-20)17-4-6-19(23)7-5-17/h4-8,11,16,18H,2-3,9-10,12-15H2,1H3/t18-/m0/s1

InChI Key

LADRGUHAEGYGEX-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27188267

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.888

Distribution Coefficient, logD

3.886

Water Solubility, LogSw

-3.93

Polar Surface Area

38.468

Acid Dissociation Constant (pKa)

22.50

Base Dissociation Constant (pKb)

4.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

F726-0330 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F726-0330 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F726-0330?
Check Price and Availability of F726-0330, 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 F726-0330 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F726-0330
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F726-0330
  • 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 F726-0330 available by request