Y021-1967 Screening compound: 5-amino-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl cyanide

Y021-1967 Screening compound: 5-amino-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl cyanide
Y021-1967 Screening compound: 5-amino-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-1967
5-amino-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl cyanide

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

Y021-1967

Molecular Formula

C7H6N6S (C7 H6 N6 S)

Compound Name

5-amino-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl cyanide

IUPAC name

5-amino-2-(methylsulfanyl)-[124]triazolo[15-a]pyrimidine-6-carbonitrile

SMILES

CSc1nn(cc(c(N)n2)C#N)c2n1

InChI

InChI=1S/C7H6N6S/c1-14-7-11-6-10-5(9)4(2-8)3-13(6)12-7/h3H,1H3,(H2,9,10,11,12)

InChI Key

AJJPTYMEFBZTLL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06755249

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

206.23

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.276

Distribution Coefficient, logD

0.276

Water Solubility, LogSw

-1.60

Polar Surface Area

67.792

Acid Dissociation Constant (pKa)

16.52

Base Dissociation Constant (pKb)

2.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.29

Y021-1967 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with Y021-1967 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-1967?
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What is the minimum amount of Y021-1967 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-1967
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-1967
  • 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 Y021-1967 available by request