8012-4240 Screening compound: 2-(5-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-5-methoxyphenyl methyl ether

8012-4240 Screening compound: 2-(5-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-5-methoxyphenyl methyl ether
8012-4240 Screening compound: 2-(5-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-5-methoxyphenyl methyl ether alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-4240
2-(5-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-5-methoxyphenyl methyl ether

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

8012-4240

Molecular Formula

C14H12ClN3O2 (C14 H12 ClN3 O2)

Compound Name

2-(5-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-5-methoxyphenyl methyl ether

IUPAC name

5-chloro-3-(24-dimethoxyphenyl)-[124]triazolo[43-a]pyridine

SMILES

COc(cc1)cc(OC)c1-c1nnc2n1c(Cl)ccc2

InChI

InChI=1S/C14H12ClN3O2/c1-19-9-6-7-10(11(8-9)20-2)14-17-16-13-5-3-4-12(15)18(13)14/h3-8H,1-2H3

InChI Key

BSDWSFRDCSMRPH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02934927

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.72

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.841

Distribution Coefficient, logD

2.841

Water Solubility, LogSw

-3.55

Polar Surface Area

36.777

Acid Dissociation Constant (pKa)

32.41

Base Dissociation Constant (pKb)

4.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.29

8012-4240 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 8012-4240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-4240?
Check Price and Availability of 8012-4240, 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 8012-4240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-4240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-4240
  • 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 8012-4240 available by request