5977-0335 Screening compound: 7-(benzyloxy)-3-[2-(propan-2-yl)phenoxy]-4H-chromen-4-one

5977-0335 Screening compound: 7-(benzyloxy)-3-[2-(propan-2-yl)phenoxy]-4H-chromen-4-one
5977-0335 Screening compound: 7-(benzyloxy)-3-[2-(propan-2-yl)phenoxy]-4H-chromen-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5977-0335
7-(benzyloxy)-3-[2-(propan-2-yl)phenoxy]-4H-chromen-4-one

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

5977-0335

Molecular Formula

C25H22O4 (C25 H22 O4)

Compound Name

7-(benzyloxy)-3-[2-(propan-2-yl)phenoxy]-4H-chromen-4-one

IUPAC name

7-(benzyloxy)-3-[2-(propan-2-yl)phenoxy]-4H-chromen-4-one

SMILES

CC(C)c(cccc1)c1OC1=COc(cc(cc2)OCc3ccccc3)c2C1=O

InChI

InChI=1S/C25H22O4/c1-17(2)20-10-6-7-11-22(20)29-24-16-28-23-14-19(12-13-21(23)25(24)26)27-15-18-8-4-3-5-9-18/h3-14,16-17H,15H2,1-2H3

InChI Key

IQQFGHMWMSYSRT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02960907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.739

Distribution Coefficient, logD

5.739

Water Solubility, LogSw

-5.58

Polar Surface Area

34.884

Acid Dissociation Constant (pKa)

24.08

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

5977-0335 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 5977-0335 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5977-0335?
Check Price and Availability of 5977-0335, 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 5977-0335 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5977-0335
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5977-0335
  • 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 5977-0335 available by request