8539-0855 Screening compound: 4-ethyl-2-[2-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-6-carbonyl]phenol

8539-0855 Screening compound: 4-ethyl-2-[2-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-6-carbonyl]phenol
8539-0855 Screening compound: 4-ethyl-2-[2-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-6-carbonyl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8539-0855
4-ethyl-2-[2-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-6-carbonyl]phenol

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

8539-0855

Molecular Formula

C22H19N3O3 (C22 H19 N3 O3)

Compound Name

4-ethyl-2-[2-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-6-carbonyl]phenol

IUPAC name

4-ethyl-2-[2-(4-methoxyphenyl)pyrazolo[15-a]pyrimidine-6-carbonyl]phenol

SMILES

CCc(cc1)cc(C(c(cnc2c3)cn2nc3-c(cc2)ccc2OC)=O)c1O

InChI

InChI=1S/C22H19N3O3/c1-3-14-4-9-20(26)18(10-14)22(27)16-12-23-21-11-19(24-25(21)13-16)15-5-7-17(28-2)8-6-15/h4-13,26H,3H2,1-2H3

InChI Key

UPXQKBZTJNFPPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08280676

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.021

Distribution Coefficient, logD

5.021

Water Solubility, LogSw

-4.25

Polar Surface Area

57.743

Acid Dissociation Constant (pKa)

11.14

Base Dissociation Constant (pKb)

2.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

8539-0855 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8539-0855 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8539-0855?
Check Price and Availability of 8539-0855, 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 8539-0855 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8539-0855
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8539-0855
  • 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 8539-0855 available by request