8002-1743 Screening compound: 2-bromo-4-(4-methoxyphenyl)-6-phenyl-3-pyridyl cyanide

8002-1743 Screening compound: 2-bromo-4-(4-methoxyphenyl)-6-phenyl-3-pyridyl cyanide
8002-1743 Screening compound: 2-bromo-4-(4-methoxyphenyl)-6-phenyl-3-pyridyl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-1743
2-bromo-4-(4-methoxyphenyl)-6-phenyl-3-pyridyl cyanide

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

8002-1743

Molecular Formula

C19H13BrN2O (C19 H13 BrN2 O)

Compound Name

2-bromo-4-(4-methoxyphenyl)-6-phenyl-3-pyridyl cyanide

IUPAC name

2-bromo-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile

SMILES

COc(cc1)ccc1-c(cc(-c1ccccc1)nc1Br)c1C#N

InChI

InChI=1S/C19H13BrN2O/c1-23-15-9-7-13(8-10-15)16-11-18(14-5-3-2-4-6-14)22-19(20)17(16)12-21/h2-11H,1H3

InChI Key

JSJINAUHXMUFLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00486958

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.23

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.626

Distribution Coefficient, logD

5.626

Water Solubility, LogSw

-5.77

Polar Surface Area

34.032

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.26

8002-1743 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8002-1743 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-1743?
Check Price and Availability of 8002-1743, 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 8002-1743 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-1743
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-1743
  • 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 8002-1743 available by request