8016-4362 Screening compound: N~3~-(5-bromo-6-methyl-2-pyridyl)-2-chloronicotinamide

8016-4362 Screening compound: N~3~-(5-bromo-6-methyl-2-pyridyl)-2-chloronicotinamide
8016-4362 Screening compound: N~3~-(5-bromo-6-methyl-2-pyridyl)-2-chloronicotinamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-4362
N~3~-(5-bromo-6-methyl-2-pyridyl)-2-chloronicotinamide

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

8016-4362

Molecular Formula

C12H9BrClN3O (C12 H9 BrClN3 O)

Compound Name

N~3~-(5-bromo-6-methyl-2-pyridyl)-2-chloronicotinamide

IUPAC name

N-(5-bromo-6-methylpyridin-2-yl)-2-chloropyridine-3-carboxamide

SMILES

Cc(nc(cc1)NC(c(cccn2)c2Cl)=O)c1Br

InChI

InChI=1S/C12H9BrClN3O/c1-7-9(13)4-5-10(16-7)17-12(18)8-3-2-6-15-11(8)14/h2-6H,1H3,(H,16,17,18)

InChI Key

YITFLVLONRQCQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03836440

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.014

Distribution Coefficient, logD

1.980

Water Solubility, LogSw

-3.74

Polar Surface Area

42.775

Acid Dissociation Constant (pKa)

6.41

Base Dissociation Constant (pKb)

2.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.33

8016-4362 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 8016-4362 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-4362?
Check Price and Availability of 8016-4362, 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 8016-4362 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-4362
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-4362
  • 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 8016-4362 available by request