0325-0438 Screening compound: 2-benzoyl-5-{2-hydroxy-3-[4-(2-hydroxybenzoyl)phenoxy]propoxy}phenol

0325-0438 Screening compound: 2-benzoyl-5-{2-hydroxy-3-[4-(2-hydroxybenzoyl)phenoxy]propoxy}phenol
0325-0438 Screening compound: 2-benzoyl-5-{2-hydroxy-3-[4-(2-hydroxybenzoyl)phenoxy]propoxy}phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0325-0438
2-benzoyl-5-{2-hydroxy-3-[4-(2-hydroxybenzoyl)phenoxy]propoxy}phenol

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

0325-0438

Molecular Formula

C29H24O7 (C29 H24 O7)

Compound Name

2-benzoyl-5-{2-hydroxy-3-[4-(2-hydroxybenzoyl)phenoxy]propoxy}phenol

IUPAC name

2-benzoyl-5-{2-hydroxy-3-[4-(2-hydroxybenzoyl)phenoxy]propoxy}phenol

SMILES

OC(COc(cc1)ccc1C(c(cccc1)c1O)=O)COc(cc1)cc(O)c1C(c1ccccc1)=O

InChI

InChI=1S/C29H24O7/c30-21(17-35-22-12-10-20(11-13-22)29(34)24-8-4-5-9-26(24)31)18-36-23-14-15-25(27(32)16-23)28(33)19-6-2-1-3-7-19/h1-16,21,30-32H,17-18H2/t21-/m0/s1

InChI Key

QYYSBBCKJDBCKA-NRFANRHFSA-N

MDL Number (MFCD)

MFCD00311300

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.840

Distribution Coefficient, logD

5.836

Water Solubility, LogSw

-5.62

Polar Surface Area

91.615

Acid Dissociation Constant (pKa)

9.43

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.30

0325-0438 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Lipid Metabolism Library (9174 compounds)

PLpro Library (6343 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
  • Metabolic
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with 0325-0438 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0325-0438?
Check Price and Availability of 0325-0438, 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 0325-0438 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0325-0438
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0325-0438
  • 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 0325-0438 available by request