4527-0002 Screening compound: 2-(4-methylphenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine

4527-0002 Screening compound: 2-(4-methylphenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
4527-0002 Screening compound: 2-(4-methylphenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4527-0002
2-(4-methylphenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]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

4527-0002

Molecular Formula

C20H14F3N3 (C20 H14 F3 N3)

Compound Name

2-(4-methylphenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine

IUPAC name

2-(4-methylphenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[15-a]pyrimidine

SMILES

Cc(cc1)ccc1-c1nn2c(C(F)(F)F)cc(-c3ccccc3)nc2c1

InChI

InChI=1S/C20H14F3N3/c1-13-7-9-15(10-8-13)17-12-19-24-16(14-5-3-2-4-6-14)11-18(20(21,22)23)26(19)25-17/h2-12H,1H3

InChI Key

DIZWVWLWWGCDJE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01970876

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.35

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.072

Distribution Coefficient, logD

6.072

Water Solubility, LogSw

-5.87

Polar Surface Area

18.126

Acid Dissociation Constant (pKa)

28.37

Base Dissociation Constant (pKb)

4.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

4527-0002 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human Proteases Annotated Library (2868 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 4527-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4527-0002?
Check Price and Availability of 4527-0002, 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 4527-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4527-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4527-0002
  • 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 4527-0002 available by request