4255-0028 Screening compound: 5-(furan-2-yl)-1-phenyl-3-(2,4,5-trimethylphenyl)-4,5-dihydro-1H-pyrazole

4255-0028 Screening compound: 5-(furan-2-yl)-1-phenyl-3-(2,4,5-trimethylphenyl)-4,5-dihydro-1H-pyrazole
4255-0028 Screening compound: 5-(furan-2-yl)-1-phenyl-3-(2,4,5-trimethylphenyl)-4,5-dihydro-1H-pyrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4255-0028
5-(furan-2-yl)-1-phenyl-3-(2,4,5-trimethylphenyl)-4,5-dihydro-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

4255-0028

Molecular Formula

C22H22N2O (C22 H22 N2 O)

Compound Name

5-(furan-2-yl)-1-phenyl-3-(2,4,5-trimethylphenyl)-4,5-dihydro-1H-pyrazole

IUPAC name

5-(furan-2-yl)-1-phenyl-3-(245-trimethylphenyl)-45-dihydro-1H-pyrazole

SMILES

Cc(c(C)c1)cc(C)c1C(CC1c2ccco2)=NN1c1ccccc1

InChI

InChI=1S/C22H22N2O/c1-15-12-17(3)19(13-16(15)2)20-14-21(22-10-7-11-25-22)24(23-20)18-8-5-4-6-9-18/h4-13,21H,14H2,1-3H3/t21-/m0/s1

InChI Key

ZPRHWSSBNDVNHQ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD01551859

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.43

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

6.165

Distribution Coefficient, logD

6.165

Water Solubility, LogSw

-5.70

Polar Surface Area

22.497

Acid Dissociation Constant (pKa)

21.99

Base Dissociation Constant (pKb)

1.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.70

4255-0028 in Drug Discovery

Included in Screening Libraries

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

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 4255-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4255-0028?
Check Price and Availability of 4255-0028, 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 4255-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4255-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4255-0028
  • 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 4255-0028 available by request