8007-8965 Screening compound: 2,5,6-trichloro-N-(4-chlorophenyl)-4-methylnicotinamide

8007-8965 Screening compound: 2,5,6-trichloro-N-(4-chlorophenyl)-4-methylnicotinamide
8007-8965 Screening compound: 2,5,6-trichloro-N-(4-chlorophenyl)-4-methylnicotinamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-8965
2,5,6-trichloro-N-(4-chlorophenyl)-4-methylnicotinamide

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

8007-8965

Molecular Formula

C13H8Cl4N2O (C13 H8 Cl4 N2 O)

Compound Name

2,5,6-trichloro-N-(4-chlorophenyl)-4-methylnicotinamide

IUPAC name

256-trichloro-N-(4-chlorophenyl)-4-methylpyridine-3-carboxamide

SMILES

Cc(c(C(Nc(cc1)ccc1Cl)=O)c(nc1Cl)Cl)c1Cl

InChI

InChI=1S/C13H8Cl4N2O/c1-6-9(11(16)19-12(17)10(6)15)13(20)18-8-4-2-7(14)3-5-8/h2-5H,1H3,(H,18,20)

InChI Key

RADBAVQAJCFQPQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01239653

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.03

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.905

Distribution Coefficient, logD

3.253

Water Solubility, LogSw

-5.26

Polar Surface Area

33.220

Acid Dissociation Constant (pKa)

5.76

Base Dissociation Constant (pKb)

-3.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.69

8007-8965 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 8007-8965 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-8965?
Check Price and Availability of 8007-8965, 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 8007-8965 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-8965
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-8965
  • 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 8007-8965 available by request