P807-0136 Screening compound: 2-(3-fluorophenyl)-N-({1-[3-(pyridin-3-yl)-1H-pyrazol-5-yl]piperidin-4-yl}methyl)acetamide

P807-0136 Screening compound: 2-(3-fluorophenyl)-N-({1-[3-(pyridin-3-yl)-1H-pyrazol-5-yl]piperidin-4-yl}methyl)acetamide
P807-0136 Screening compound: 2-(3-fluorophenyl)-N-({1-[3-(pyridin-3-yl)-1H-pyrazol-5-yl]piperidin-4-yl}methyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P807-0136
2-(3-fluorophenyl)-N-({1-[3-(pyridin-3-yl)-1H-pyrazol-5-yl]piperidin-4-yl}methyl)acetamide

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

P807-0136

Molecular Formula

C22H24FN5O (C22 H24 FN5 O)

Compound Name

2-(3-fluorophenyl)-N-({1-[3-(pyridin-3-yl)-1H-pyrazol-5-yl]piperidin-4-yl}methyl)acetamide

IUPAC name

2-(3-fluorophenyl)-N-({1-[3-(pyridin-3-yl)-1H-pyrazol-5-yl]piperidin-4-yl}methyl)acetamide

SMILES

O=C(Cc1cccc(F)c1)NCC(CC1)CCN1c1cc(-c2cnccc2)n[nH]1

InChI

InChI=1S/C22H24FN5O/c23-19-5-1-3-17(11-19)12-22(29)25-14-16-6-9-28(10-7-16)21-13-20(26-27-21)18-4-2-8-24-15-18/h1-5,8,11,13,15-16H,6-7,9-10,12,14H2,(H,25,29)(H,26,27)

InChI Key

RVZNZIJWVRLGRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27615426

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.674

Distribution Coefficient, logD

2.665

Water Solubility, LogSw

-2.69

Polar Surface Area

59.362

Acid Dissociation Constant (pKa)

14.17

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

P807-0136 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with P807-0136 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P807-0136?
Check Price and Availability of P807-0136, 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 P807-0136 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P807-0136
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P807-0136
  • 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 P807-0136 available by request