0558-0009 Screening compound: 2-(5-bromo-2-methoxyphenyl)-1,3-diphenylimidazolidine

0558-0009 Screening compound: 2-(5-bromo-2-methoxyphenyl)-1,3-diphenylimidazolidine
0558-0009 Screening compound: 2-(5-bromo-2-methoxyphenyl)-1,3-diphenylimidazolidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0558-0009
2-(5-bromo-2-methoxyphenyl)-1,3-diphenylimidazolidine

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

0558-0009

Molecular Formula

C22H21BrN2O (C22 H21 BrN2 O)

Compound Name

2-(5-bromo-2-methoxyphenyl)-1,3-diphenylimidazolidine

IUPAC name

2-(5-bromo-2-methoxyphenyl)-13-diphenylimidazolidine

SMILES

COc(cc1)c(C(N(CC2)c3ccccc3)N2c2ccccc2)cc1Br

InChI

InChI=1S/C22H21BrN2O/c1-26-21-13-12-17(23)16-20(21)22-24(18-8-4-2-5-9-18)14-15-25(22)19-10-6-3-7-11-19/h2-13,16,22H,14-15H2,1H3

InChI Key

RTEHBMUCORAUQD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00653187

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.33

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.807

Distribution Coefficient, logD

5.807

Water Solubility, LogSw

-5.65

Polar Surface Area

13.817

Acid Dissociation Constant (pKa)

22.75

Base Dissociation Constant (pKb)

0.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

0558-0009 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 0558-0009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0558-0009?
Check Price and Availability of 0558-0009, 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 0558-0009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0558-0009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0558-0009
  • 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 0558-0009 available by request