F950-0102 Screening compound: 3-bromo-5-(3-{3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazol-5-yl}-1,2,4-oxadiazol-5-yl)pyridine

F950-0102 Screening compound: 3-bromo-5-(3-{3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazol-5-yl}-1,2,4-oxadiazol-5-yl)pyridine
F950-0102 Screening compound: 3-bromo-5-(3-{3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazol-5-yl}-1,2,4-oxadiazol-5-yl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound F950-0102
3-bromo-5-(3-{3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazol-5-yl}-1,2,4-oxadiazol-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

F950-0102

Molecular Formula

C19H12BrN5OS (C19 H12 BrN5 OS)

Compound Name

3-bromo-5-(3-{3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazol-5-yl}-1,2,4-oxadiazol-5-yl)pyridine

IUPAC name

3-bromo-5-(3-{3-methyl-1-phenyl-1H-thieno[23-c]pyrazol-5-yl}-124-oxadiazol-5-yl)pyridine

SMILES

Cc(c1c2sc(-c3noc(-c4cc(Br)cnc4)n3)c1)nn2-c1ccccc1

InChI

InChI=1S/C19H12BrN5OS/c1-11-15-8-16(27-19(15)25(23-11)14-5-3-2-4-6-14)17-22-18(26-24-17)12-7-13(20)10-21-9-12/h2-10H,1H3

InChI Key

MPHISLJSHFHVLJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14973493

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.978

Distribution Coefficient, logD

4.978

Water Solubility, LogSw

-4.64

Polar Surface Area

56.026

Acid Dissociation Constant (pKa)

31.12

Base Dissociation Constant (pKb)

3.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

F950-0102 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F950-0102 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F950-0102?
Check Price and Availability of F950-0102, 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 F950-0102 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F950-0102
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F950-0102
  • 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 F950-0102 available by request