P168-0130 Screening compound: N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

P168-0130 Screening compound: N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
P168-0130 Screening compound: N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrolo[2,3-b]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P168-0130
N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrolo[2,3-b]pyridine-3-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

P168-0130

Molecular Formula

C16H12F3N3O (C16 H12 F3 N3 O)

Compound Name

N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

IUPAC name

N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrrolo[23-b]pyridine-3-carboxamide

SMILES

O=C(c1c[nH]c2c1cccn2)NCc1cccc(C(F)(F)F)c1

InChI

InChI=1S/C16H12F3N3O/c17-16(18,19)11-4-1-3-10(7-11)8-22-15(23)13-9-21-14-12(13)5-2-6-20-14/h1-7,9H,8H2,(H,20,21)(H,22,23)

InChI Key

BVVNPFIIAZXZBR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20527475

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.29

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.125

Distribution Coefficient, logD

3.125

Water Solubility, LogSw

-3.40

Polar Surface Area

44.897

Acid Dissociation Constant (pKa)

13.85

Base Dissociation Constant (pKb)

1.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

P168-0130 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Cardiovascular Library (22201 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P168-0130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P168-0130?
Check Price and Availability of P168-0130, 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 P168-0130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P168-0130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P168-0130
  • 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 P168-0130 available by request