F812-0839 Screening compound: N-[2-(1H-indol-3-yl)ethyl]-3-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide

F812-0839 Screening compound: N-[2-(1H-indol-3-yl)ethyl]-3-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
F812-0839 Screening compound: N-[2-(1H-indol-3-yl)ethyl]-3-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F812-0839
N-[2-(1H-indol-3-yl)ethyl]-3-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-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

F812-0839

Molecular Formula

C23H19N5O (C23 H19 N5 O)

Compound Name

N-[2-(1H-indol-3-yl)ethyl]-3-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide

IUPAC name

N-[2-(1H-indol-3-yl)ethyl]-3-phenyl-[124]triazolo[43-a]pyridine-6-carboxamide

SMILES

O=C(c1cn2c(-c3ccccc3)nnc2cc1)NCCc1c[nH]c2c1cccc2

InChI

InChI=1S/C23H19N5O/c29-23(24-13-12-17-14-25-20-9-5-4-8-19(17)20)18-10-11-21-26-27-22(28(21)15-18)16-6-2-1-3-7-16/h1-11,14-15,25H,12-13H2,(H,24,29)

InChI Key

YSPOKANYTUALOW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27193190

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.441

Distribution Coefficient, logD

3.441

Water Solubility, LogSw

-3.45

Polar Surface Area

55.596

Acid Dissociation Constant (pKa)

13.81

Base Dissociation Constant (pKb)

3.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

F812-0839 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Antibacterial Compounds Library (13827 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Others

References: we are preparing a list of scientific research reports with F812-0839 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F812-0839?
Check Price and Availability of F812-0839, 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 F812-0839 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F812-0839
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F812-0839
  • 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 F812-0839 available by request