Y021-0254 Screening compound: 1-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperidine

Y021-0254 Screening compound: 1-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperidine
Y021-0254 Screening compound: 1-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-0254
1-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperidine

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

Y021-0254

Molecular Formula

C12H17N5 (C12 H17 N5)

Compound Name

1-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}piperidine

IUPAC name

1-{57-dimethyl-[124]triazolo[15-a]pyrimidin-2-yl}piperidine

SMILES

Cc1cc(C)nc2nc(N3CCCCC3)nn12

InChI

InChI=1S/C12H17N5/c1-9-8-10(2)17-11(13-9)14-12(15-17)16-6-4-3-5-7-16/h8H,3-7H2,1-2H3

InChI Key

NYFKKAVJHZESAS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27936945

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

231.3

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.793

Distribution Coefficient, logD

1.791

Water Solubility, LogSw

-1.36

Polar Surface Area

33.209

Acid Dissociation Constant (pKa)

20.00

Base Dissociation Constant (pKb)

5.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.33

Y021-0254 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

CNS BBB Library (22607 compounds)

CNS MPO Library (28609 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y021-0254 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-0254?
Check Price and Availability of Y021-0254, 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 Y021-0254 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-0254
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-0254
  • 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 Y021-0254 available by request