Y021-0222 Screening compound: 7-amino-2-(4-chlorophenyl)-4H,5H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one

Y021-0222 Screening compound: 7-amino-2-(4-chlorophenyl)-4H,5H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
Y021-0222 Screening compound: 7-amino-2-(4-chlorophenyl)-4H,5H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-0222
7-amino-2-(4-chlorophenyl)-4H,5H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one

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

Y021-0222

Molecular Formula

C11H8ClN5O (C11 H8 ClN5 O)

Compound Name

7-amino-2-(4-chlorophenyl)-4H,5H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one

IUPAC name

7-amino-2-(4-chlorophenyl)-4H5H-[124]triazolo[15-a]pyrimidin-5-one

SMILES

NC(n1nc(-c(cc2)ccc2Cl)nc1N1)=CC1=O

InChI

InChI=1S/C11H8ClN5O/c12-7-3-1-6(2-4-7)10-15-11-14-9(18)5-8(13)17(11)16-10/h1-5H,13H2,(H,14,15,16,18)

InChI Key

HHEGPLQDCOLCQZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26105368

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

261.67

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.730

Distribution Coefficient, logD

1.730

Water Solubility, LogSw

-2.80

Polar Surface Area

69.642

Acid Dissociation Constant (pKa)

12.51

Base Dissociation Constant (pKb)

-2.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

Y021-0222 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with Y021-0222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-0222?
Check Price and Availability of Y021-0222, 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 Y021-0222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-0222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-0222
  • 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 Y021-0222 available by request