P805-0974 Screening compound: N-{1-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidin-4-yl}-1H-indole-5-carboxamide

P805-0974 Screening compound: N-{1-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidin-4-yl}-1H-indole-5-carboxamide
P805-0974 Screening compound: N-{1-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidin-4-yl}-1H-indole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P805-0974
N-{1-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidin-4-yl}-1H-indole-5-carboxamide

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

P805-0974

Molecular Formula

C23H22FN5O (C23 H22 FN5 O)

Compound Name

N-{1-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidin-4-yl}-1H-indole-5-carboxamide

IUPAC name

N-{1-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidin-4-yl}-1H-indole-5-carboxamide

SMILES

O=C(c(cc1)cc2c1[nH]cc2)NC(CC1)CCN1c1cc(-c(cc2)ccc2F)n[nH]1

InChI

InChI=1S/C23H22FN5O/c24-18-4-1-15(2-5-18)21-14-22(28-27-21)29-11-8-19(9-12-29)26-23(30)17-3-6-20-16(13-17)7-10-25-20/h1-7,10,13-14,19,25H,8-9,11-12H2,(H,26,30)(H,27,28)

InChI Key

UMYWGNKMJXFBJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28043099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.46

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.862

Distribution Coefficient, logD

3.862

Water Solubility, LogSw

-4.12

Polar Surface Area

59.372

Acid Dissociation Constant (pKa)

14.80

Base Dissociation Constant (pKb)

0.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

P805-0974 in Drug Discovery

Included in Screening Libraries

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

Bcl2-PPI Inhibitors Library (12246 compounds)

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

Bromodomain Modulators Library (5801 compounds)

Indole Derivatives (10091 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
  • Cyclic compounds
  • Mimetics
  • Cyclic compounds
Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with P805-0974 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P805-0974?
Check Price and Availability of P805-0974, 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 P805-0974 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P805-0974
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P805-0974
  • 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 P805-0974 available by request