2214-0042 Screening compound: 2-[3-(4-bromophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-6-methyl-4-phenylquinazoline

2214-0042 Screening compound: 2-[3-(4-bromophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-6-methyl-4-phenylquinazoline
2214-0042 Screening compound: 2-[3-(4-bromophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-6-methyl-4-phenylquinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 2214-0042
2-[3-(4-bromophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-6-methyl-4-phenylquinazoline

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

2214-0042

Molecular Formula

C30H22BrFN4 (C30 H22 BrFN4)

Compound Name

2-[3-(4-bromophenyl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-6-methyl-4-phenylquinazoline

IUPAC name

2-[3-(4-bromophenyl)-5-(4-fluorophenyl)-45-dihydro-1H-pyrazol-1-yl]-6-methyl-4-phenylquinazoline

SMILES

Cc1ccc2nc(N(C(C3)c(cc4)ccc4F)N=C3c(cc3)ccc3Br)nc(-c3ccccc3)c2c1

InChI

InChI=1S/C30H22BrFN4/c1-19-7-16-26-25(17-19)29(22-5-3-2-4-6-22)34-30(33-26)36-28(21-10-14-24(32)15-11-21)18-27(35-36)20-8-12-23(31)13-9-20/h2-17,28H,18H2,1H3/t28-/m1/s1

InChI Key

ACZQFEYQOFLWGU-MUUNZHRXSA-N

MDL Number (MFCD)

MFCD01535245

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

8.802

Distribution Coefficient, logD

8.800

Water Solubility, LogSw

-6.05

Polar Surface Area

31.631

Acid Dissociation Constant (pKa)

9.77

Base Dissociation Constant (pKb)

3.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.00

2214-0042 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 2214-0042 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2214-0042?
Check Price and Availability of 2214-0042, 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 2214-0042 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2214-0042
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2214-0042
  • 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 2214-0042 available by request