Y021-1469 Screening compound: 3-(methylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole

Y021-1469 Screening compound: 3-(methylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole
Y021-1469 Screening compound: 3-(methylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-1469
3-(methylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole

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

Y021-1469

Molecular Formula

C10H8N4S (C10 H8 N4 S)

Compound Name

3-(methylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole

IUPAC name

3-(methylsulfanyl)-5H-[124]triazino[56-b]indole

SMILES

CSc1nnc(c(cccc2)c2[nH]2)c2n1

InChI

InChI=1S/C10H8N4S/c1-15-10-12-9-8(13-14-10)6-4-2-3-5-7(6)11-9/h2-5H,1H3,(H,11,12,14)

InChI Key

CTOXAONEYODXLL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00170136

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

216.27

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.817

Distribution Coefficient, logD

1.817

Water Solubility, LogSw

-2.14

Polar Surface Area

41.806

Acid Dissociation Constant (pKa)

17.75

Base Dissociation Constant (pKb)

0.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

Y021-1469 in Drug Discovery

Included in Screening Libraries

CNS Annotated Library (688 compounds)

Fragments Library (11262 compounds)

Human GPCR Annotated Library (5539 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y021-1469 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-1469?
Check Price and Availability of Y021-1469, 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 Y021-1469 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-1469
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-1469
  • 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 Y021-1469 available by request