6228-1328 Screening compound: 4-bromo-3,5-dimethyl-1-{4-[(4-propylphenoxy)methyl]benzoyl}-1H-pyrazole

6228-1328 Screening compound: 4-bromo-3,5-dimethyl-1-{4-[(4-propylphenoxy)methyl]benzoyl}-1H-pyrazole
6228-1328 Screening compound: 4-bromo-3,5-dimethyl-1-{4-[(4-propylphenoxy)methyl]benzoyl}-1H-pyrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 6228-1328
4-bromo-3,5-dimethyl-1-{4-[(4-propylphenoxy)methyl]benzoyl}-1H-pyrazole

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

6228-1328

Molecular Formula

C22H23BrN2O2 (C22 H23 BrN2 O2)

Compound Name

4-bromo-3,5-dimethyl-1-{4-[(4-propylphenoxy)methyl]benzoyl}-1H-pyrazole

IUPAC name

4-bromo-35-dimethyl-1-{4-[(4-propylphenoxy)methyl]benzoyl}-1H-pyrazole

SMILES

CCCc(cc1)ccc1OCc(cc1)ccc1C(n1nc(C)c(Br)c1C)=O

InChI

InChI=1S/C22H23BrN2O2/c1-4-5-17-8-12-20(13-9-17)27-14-18-6-10-19(11-7-18)22(26)25-16(3)21(23)15(2)24-25/h6-13H,4-5,14H2,1-3H3

InChI Key

JPEGVYSIFUPPNU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02055592

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.180

Distribution Coefficient, logD

5.180

Water Solubility, LogSw

-5.16

Polar Surface Area

35.080

Acid Dissociation Constant (pKa)

26.80

Base Dissociation Constant (pKb)

-1.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

6228-1328 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

Antibacterial Compounds Library (13827 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Infections
  • Immune system
  • animal
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6228-1328 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6228-1328?
Check Price and Availability of 6228-1328, 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 6228-1328 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6228-1328
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6228-1328
  • 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 6228-1328 available by request