8016-1225 Screening compound: 3-(methylsulfanyl)[1,2,4]triazolo[4,3-a]pyridin-8-yl morpholino sulfone

8016-1225 Screening compound: 3-(methylsulfanyl)[1,2,4]triazolo[4,3-a]pyridin-8-yl morpholino sulfone
8016-1225 Screening compound: 3-(methylsulfanyl)[1,2,4]triazolo[4,3-a]pyridin-8-yl morpholino sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-1225
3-(methylsulfanyl)[1,2,4]triazolo[4,3-a]pyridin-8-yl morpholino sulfone

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

8016-1225

Molecular Formula

C11H14N4O3S2 (C11 H14 N4 O3 S2)

Compound Name

3-(methylsulfanyl)[1,2,4]triazolo[4,3-a]pyridin-8-yl morpholino sulfone

IUPAC name

4-{[3-(methylsulfanyl)-[124]triazolo[43-a]pyridin-8-yl]sulfonyl}morpholine

SMILES

CSc1nnc2n1cccc2S(N1CCOCC1)(=O)=O

InChI

InChI=1S/C11H14N4O3S2/c1-19-11-13-12-10-9(3-2-4-15(10)11)20(16,17)14-5-7-18-8-6-14/h2-4H,5-8H2,1H3

InChI Key

VNDNVSWZQVWLNB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05260347

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.39

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.181

Distribution Coefficient, logD

0.181

Water Solubility, LogSw

-1.68

Polar Surface Area

62.596

Acid Dissociation Constant (pKa)

27.57

Base Dissociation Constant (pKb)

-1.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.46

8016-1225 in Drug Discovery

Included in Screening Libraries

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

Akt-Targeted Library (14764 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8016-1225 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-1225?
Check Price and Availability of 8016-1225, 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 8016-1225 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-1225
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-1225
  • 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 8016-1225 available by request