M670-0898 Screening compound: {4-[1-(4-fluorophenyl)-1H-pyrazol-4-yl]piperidino}(4-pyridyl)methanone

M670-0898 Screening compound: {4-[1-(4-fluorophenyl)-1H-pyrazol-4-yl]piperidino}(4-pyridyl)methanone
M670-0898 Screening compound: {4-[1-(4-fluorophenyl)-1H-pyrazol-4-yl]piperidino}(4-pyridyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound M670-0898
{4-[1-(4-fluorophenyl)-1H-pyrazol-4-yl]piperidino}(4-pyridyl)methanone

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

M670-0898

Molecular Formula

C20H19FN4O (C20 H19 FN4 O)

Compound Name

{4-[1-(4-fluorophenyl)-1H-pyrazol-4-yl]piperidino}(4-pyridyl)methanone

IUPAC name

4-{4-[1-(4-fluorophenyl)-1H-pyrazol-4-yl]piperidine-1-carbonyl}pyridine

SMILES

O=C(c1ccncc1)N(CC1)CCC1c1cn(-c(cc2)ccc2F)nc1

InChI

InChI=1S/C20H19FN4O/c21-18-1-3-19(4-2-18)25-14-17(13-23-25)15-7-11-24(12-8-15)20(26)16-5-9-22-10-6-16/h1-6,9-10,13-15H,7-8,11-12H2

InChI Key

PWESKOPLUOPFDD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27550402

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.4

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

2.431

Distribution Coefficient, logD

2.428

Water Solubility, LogSw

-2.03

Polar Surface Area

40.401

Acid Dissociation Constant (pKa)

21.47

Base Dissociation Constant (pKb)

5.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

M670-0898 in Drug Discovery

Included in Screening Libraries

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

DGK Inhibitors Library (10558 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M670-0898 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M670-0898?
Check Price and Availability of M670-0898, 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 M670-0898 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M670-0898
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M670-0898
  • 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 M670-0898 available by request