0368-0008 Screening compound: 6-METHYLPYRIDIN-3-YL 4-CHLORO-3-NITROBENZOATE

0368-0008 Screening compound: 6-METHYLPYRIDIN-3-YL 4-CHLORO-3-NITROBENZOATE
0368-0008 Screening compound: 6-METHYLPYRIDIN-3-YL 4-CHLORO-3-NITROBENZOATE alternative view

Chemical Structure Depiction of ChemDiv screening compound 0368-0008
6-METHYLPYRIDIN-3-YL 4-CHLORO-3-NITROBENZOATE

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

0368-0008

Molecular Formula

C13H9ClN2O4 (C13 H9 ClN2 O4)

Compound Name

6-METHYLPYRIDIN-3-YL 4-CHLORO-3-NITROBENZOATE

IUPAC name

n/a

SMILES

Cc(cc1)ncc1OC(c(cc1)cc([N+]([O-])=O)c1Cl)=O

InChI

InChI=1S/C13H9ClN2O4/c1-8-2-4-10(7-15-8)20-13(17)9-3-5-11(14)12(6-9)16(18)19/h2-7H,1H3

InChI Key

OOIKGNOQVAXYPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00989708

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.68

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.675

Distribution Coefficient, logD

2.675

Water Solubility, LogSw

-3.49

Polar Surface Area

62.641

Acid Dissociation Constant (pKa)

30.05

Base Dissociation Constant (pKb)

3.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.00

0368-0008 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with 0368-0008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0368-0008?
Check Price and Availability of 0368-0008, 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 0368-0008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0368-0008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0368-0008
  • 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 0368-0008 available by request