Y020-4247 Screening compound: 4-{7-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-2-(4-methylpiperazin-1-yl)pyrimidine

Y020-4247 Screening compound: 4-{7-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-2-(4-methylpiperazin-1-yl)pyrimidine
Y020-4247 Screening compound: 4-{7-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-2-(4-methylpiperazin-1-yl)pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-4247
4-{7-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-2-(4-methylpiperazin-1-yl)pyrimidine

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

Y020-4247

Molecular Formula

C21H22N8 (C21 H22 N8)

Compound Name

4-{7-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-2-(4-methylpiperazin-1-yl)pyrimidine

IUPAC name

4-{7-methyl-2-phenyl-[124]triazolo[15-a]pyrimidin-6-yl}-2-(4-methylpiperazin-1-yl)pyrimidine

SMILES

Cc(n1nc(-c2ccccc2)nc1nc1)c1-c1ccnc(N2CCN(C)CC2)n1

InChI

InChI=1S/C21H22N8/c1-15-17(18-8-9-22-20(24-18)28-12-10-27(2)11-13-28)14-23-21-25-19(26-29(15)21)16-6-4-3-5-7-16/h3-9,14H,10-13H2,1-2H3

InChI Key

FZLTUOHWEVEKPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18486896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.612

Distribution Coefficient, logD

2.040

Water Solubility, LogSw

-2.67

Polar Surface Area

55.637

Acid Dissociation Constant (pKa)

20.58

Base Dissociation Constant (pKb)

7.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

Y020-4247 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y020-4247 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-4247?
Check Price and Availability of Y020-4247, 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 Y020-4247 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-4247
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-4247
  • 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 Y020-4247 available by request