8018-6420 Screening compound: N-(2-chloropyridin-3-yl)-3-methoxybenzamide

8018-6420 Screening compound: N-(2-chloropyridin-3-yl)-3-methoxybenzamide
8018-6420 Screening compound: N-(2-chloropyridin-3-yl)-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-6420
N-(2-chloropyridin-3-yl)-3-methoxybenzamide

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

8018-6420

Molecular Formula

C13H11ClN2O2 (C13 H11 ClN2 O2)

Compound Name

N-(2-chloropyridin-3-yl)-3-methoxybenzamide

IUPAC name

N-(2-chloropyridin-3-yl)-3-methoxybenzamide

SMILES

COc1cccc(C(Nc2cccnc2Cl)=O)c1

InChI

InChI=1S/C13H11ClN2O2/c1-18-10-5-2-4-9(8-10)13(17)16-11-6-3-7-15-12(11)14/h2-8H,1H3,(H,16,17)

InChI Key

VGUJWZXLRCDEIW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03393470

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

262.7

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.519

Distribution Coefficient, logD

2.516

Water Solubility, LogSw

-3.45

Polar Surface Area

39.861

Acid Dissociation Constant (pKa)

9.52

Base Dissociation Constant (pKb)

-0.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

8018-6420 in Drug Discovery

Included in Screening Libraries

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

?ysteine Targeted Covalent Library (39471 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8018-6420 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-6420?
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What is the minimum amount of 8018-6420 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-6420
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-6420
  • 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 8018-6420 available by request