8020-2289 Screening compound: 4-[3-(3-nitrophenyl)-1H-1,2,4-triazol-5-yl]pyridine

8020-2289 Screening compound: 4-[3-(3-nitrophenyl)-1H-1,2,4-triazol-5-yl]pyridine
8020-2289 Screening compound: 4-[3-(3-nitrophenyl)-1H-1,2,4-triazol-5-yl]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-2289
4-[3-(3-nitrophenyl)-1H-1,2,4-triazol-5-yl]pyridine

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

8020-2289

Molecular Formula

C13H9N5O2 (C13 H9 N5 O2)

Compound Name

4-[3-(3-nitrophenyl)-1H-1,2,4-triazol-5-yl]pyridine

IUPAC name

4-[3-(3-nitrophenyl)-1H-124-triazol-5-yl]pyridine

SMILES

[O-][N+](c1cc(-c2n[nH]c(-c3ccncc3)n2)ccc1)=O

InChI

InChI=1S/C13H9N5O2/c19-18(20)11-3-1-2-10(8-11)13-15-12(16-17-13)9-4-6-14-7-5-9/h1-8H,(H,15,16,17)

InChI Key

PZZVGXITAOLHDE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06297770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

267.25

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.550

Distribution Coefficient, logD

2.461

Water Solubility, LogSw

-2.51

Polar Surface Area

76.561

Acid Dissociation Constant (pKa)

8.04

Base Dissociation Constant (pKb)

4.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8020-2289 in Drug Discovery

Included in Screening Libraries

Proline Kinase Library (2105 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8020-2289 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-2289?
Check Price and Availability of 8020-2289, 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 8020-2289 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-2289
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-2289
  • 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 8020-2289 available by request