E956-0119 Screening compound: 7-(2-fluorophenyl)-5-(4-methoxyphenyl)-N-(4-methylphenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

E956-0119 Screening compound: 7-(2-fluorophenyl)-5-(4-methoxyphenyl)-N-(4-methylphenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
E956-0119 Screening compound: 7-(2-fluorophenyl)-5-(4-methoxyphenyl)-N-(4-methylphenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E956-0119
7-(2-fluorophenyl)-5-(4-methoxyphenyl)-N-(4-methylphenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

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

E956-0119

Molecular Formula

C27H23FN4O2 (C27 H23 FN4 O2)

Compound Name

7-(2-fluorophenyl)-5-(4-methoxyphenyl)-N-(4-methylphenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

IUPAC name

7-(2-fluorophenyl)-5-(4-methoxyphenyl)-N-(4-methylphenyl)-4H7H-pyrazolo[15-a]pyrimidine-3-carboxamide

SMILES

Cc(cc1)ccc1NC(c1c(NC(c(cc2)ccc2OC)=CC2c(cccc3)c3F)n2nc1)=O

InChI

InChI=1S/C27H23FN4O2/c1-17-7-11-19(12-8-17)30-27(33)22-16-29-32-25(21-5-3-4-6-23(21)28)15-24(31-26(22)32)18-9-13-20(34-2)14-10-18/h3-16,25,31H,1-2H3,(H,30,33)/t25-/m0/s1

InChI Key

HBSIGOJQWGDTAY-VWLOTQADSA-N

MDL Number (MFCD)

MFCD14931833

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.823

Distribution Coefficient, logD

5.823

Water Solubility, LogSw

-5.49

Polar Surface Area

55.409

Acid Dissociation Constant (pKa)

10.72

Base Dissociation Constant (pKb)

-1.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

11.10

E956-0119 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Adenosine Receptors Targeted Library (19896 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
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E956-0119 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E956-0119?
Check Price and Availability of E956-0119, 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 E956-0119 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E956-0119
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E956-0119
  • 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 E956-0119 available by request