2085-0017 Screening compound: 6-bromo-2-[5-(4-bromophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-phenylquinazoline

2085-0017 Screening compound: 6-bromo-2-[5-(4-bromophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-phenylquinazoline
2085-0017 Screening compound: 6-bromo-2-[5-(4-bromophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-phenylquinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 2085-0017
6-bromo-2-[5-(4-bromophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-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

2085-0017

Molecular Formula

C30H22Br2N4O (C30 H22 Br2 N4 O)

Compound Name

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

IUPAC name

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

SMILES

COc(cc1)ccc1C(CC1c(cc2)ccc2Br)=NN1c1nc(-c2ccccc2)c(cc(cc2)Br)c2n1

InChI

InChI=1S/C30H22Br2N4O/c1-37-24-14-9-19(10-15-24)27-18-28(20-7-11-22(31)12-8-20)36(35-27)30-33-26-16-13-23(32)17-25(26)29(34-30)21-5-3-2-4-6-21/h2-17,28H,18H2,1H3/t28-/m0/s1

InChI Key

KJJIQQDJTQTGDH-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD01152712

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

614.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

9.022

Distribution Coefficient, logD

9.020

Water Solubility, LogSw

-6.02

Polar Surface Area

39.174

Acid Dissociation Constant (pKa)

9.77

Base Dissociation Constant (pKb)

3.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with 2085-0017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2085-0017?
Check Price and Availability of 2085-0017, 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 2085-0017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2085-0017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2085-0017
  • 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 2085-0017 available by request