8020-1949 Screening compound: ethyl 2-chloroisonicotinate

8020-1949 Screening compound: ethyl 2-chloroisonicotinate
8020-1949 Screening compound: ethyl 2-chloroisonicotinate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-1949
ethyl 2-chloroisonicotinate

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

8020-1949

Molecular Formula

C8H8ClNO2 (C8 H8 ClNO2)

Compound Name

ethyl 2-chloroisonicotinate

IUPAC name

ethyl 2-chloropyridine-4-carboxylate

SMILES

CCOC(c1cc(Cl)ncc1)=O

InChI

InChI=1S/C8H8ClNO2/c1-2-12-8(11)6-3-4-10-7(9)5-6/h3-5H,2H2,1H3

InChI Key

IGRLNCOFYMWKBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04114259

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

185.61

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.262

Distribution Coefficient, logD

2.262

Water Solubility, LogSw

-3.02

Polar Surface Area

29.907

Acid Dissociation Constant (pKa)

30.16

Base Dissociation Constant (pKb)

0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

8020-1949 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8020-1949 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-1949?
Check Price and Availability of 8020-1949, 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 8020-1949 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-1949
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-1949
  • 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 8020-1949 available by request