0160-0837 Screening compound: 3-(4-bromophenyl)-1-(3,4-dichlorophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazole

0160-0837 Screening compound: 3-(4-bromophenyl)-1-(3,4-dichlorophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazole
0160-0837 Screening compound: 3-(4-bromophenyl)-1-(3,4-dichlorophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0160-0837
3-(4-bromophenyl)-1-(3,4-dichlorophenyl)-5-(4-fluorophenyl)-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

0160-0837

Molecular Formula

C21H14BrCl2FN2 (C21 H14 BrCl2 FN2)

Compound Name

3-(4-bromophenyl)-1-(3,4-dichlorophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazole

IUPAC name

3-(4-bromophenyl)-1-(34-dichlorophenyl)-5-(4-fluorophenyl)-45-dihydro-1H-pyrazole

SMILES

Fc1ccc(C(C2)N(c(cc3)cc(Cl)c3Cl)N=C2c(cc2)ccc2Br)cc1

InChI

InChI=1S/C21H14BrCl2FN2/c22-15-5-1-13(2-6-15)20-12-21(14-3-7-16(25)8-4-14)27(26-20)17-9-10-18(23)19(24)11-17/h1-11,21H,12H2/t21-/m1/s1

InChI Key

RXQPPUALABYVLD-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD00367802

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.16

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

7.856

Distribution Coefficient, logD

7.856

Water Solubility, LogSw

-7.12

Polar Surface Area

13.919

Acid Dissociation Constant (pKa)

16.48

Base Dissociation Constant (pKb)

-0.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

9.50

0160-0837 in Drug Discovery

Included in Screening Libraries

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 0160-0837 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0160-0837?
Check Price and Availability of 0160-0837, 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 0160-0837 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0160-0837
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0160-0837
  • 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 0160-0837 available by request