8020-5421 Screening compound: 3-(4-bromo-1H-pyrazol-3-yl)pyridine

8020-5421 Screening compound: 3-(4-bromo-1H-pyrazol-3-yl)pyridine
8020-5421 Screening compound: 3-(4-bromo-1H-pyrazol-3-yl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-5421
3-(4-bromo-1H-pyrazol-3-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

8020-5421

Molecular Formula

C8H6BrN3 (C8 H6 BrN3)

Compound Name

3-(4-bromo-1H-pyrazol-3-yl)pyridine

IUPAC name

3-(4-bromo-1H-pyrazol-3-yl)pyridine

SMILES

Brc1c[nH]nc1-c1cnccc1

InChI

InChI=1S/C8H6BrN3/c9-7-5-11-12-8(7)6-2-1-3-10-4-6/h1-5H,(H,11,12)

InChI Key

QPQAWYNVLARCIB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14657916

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

224.06

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.522

Distribution Coefficient, logD

1.518

Water Solubility, LogSw

-0.98

Polar Surface Area

33.946

Acid Dissociation Constant (pKa)

13.60

Base Dissociation Constant (pKb)

5.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8020-5421 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

Crystallographic and 19F NMR fragment-libraries (624 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8020-5421 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-5421?
Check Price and Availability of 8020-5421, 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 8020-5421 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-5421
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-5421
  • 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 8020-5421 available by request