E238-0253 Screening compound: 2-(4-ethoxyphenyl)-1-[7-(4-fluorophenyl)-5-phenyl-4H,7H-pyrazolo[1,5-a]pyrimidin-3-yl]ethan-1-one

E238-0253 Screening compound: 2-(4-ethoxyphenyl)-1-[7-(4-fluorophenyl)-5-phenyl-4H,7H-pyrazolo[1,5-a]pyrimidin-3-yl]ethan-1-one
E238-0253 Screening compound: 2-(4-ethoxyphenyl)-1-[7-(4-fluorophenyl)-5-phenyl-4H,7H-pyrazolo[1,5-a]pyrimidin-3-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E238-0253
2-(4-ethoxyphenyl)-1-[7-(4-fluorophenyl)-5-phenyl-4H,7H-pyrazolo[1,5-a]pyrimidin-3-yl]ethan-1-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

E238-0253

Molecular Formula

C28H24FN3O2 (C28 H24 FN3 O2)

Compound Name

2-(4-ethoxyphenyl)-1-[7-(4-fluorophenyl)-5-phenyl-4H,7H-pyrazolo[1,5-a]pyrimidin-3-yl]ethan-1-one

IUPAC name

2-(4-ethoxyphenyl)-1-[7-(4-fluorophenyl)-5-phenyl-4H7H-pyrazolo[15-a]pyrimidin-3-yl]ethan-1-one

SMILES

CCOc1ccc(CC(c2c(NC(c3ccccc3)=CC3c(cc4)ccc4F)n3nc2)=O)cc1

InChI

InChI=1S/C28H24FN3O2/c1-2-34-23-14-8-19(9-15-23)16-27(33)24-18-30-32-26(21-10-12-22(29)13-11-21)17-25(31-28(24)32)20-6-4-3-5-7-20/h3-15,17-18,26,31H,2,16H2,1H3/t26-/m0/s1

InChI Key

PQTVKDQJFDKYBL-SANMLTNESA-N

MDL Number (MFCD)

MFCD14851933

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.884

Distribution Coefficient, logD

5.869

Water Solubility, LogSw

-5.50

Polar Surface Area

44.873

Acid Dissociation Constant (pKa)

8.84

Base Dissociation Constant (pKb)

-6.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

14.30

E238-0253 in Drug Discovery

Included in Screening Libraries

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with E238-0253 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E238-0253?
Check Price and Availability of E238-0253, 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 E238-0253 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E238-0253
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E238-0253
  • 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 E238-0253 available by request