3643-2416 Screening compound: 3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl 3,4,5-trimethoxybenzoate

3643-2416 Screening compound: 3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl 3,4,5-trimethoxybenzoate
3643-2416 Screening compound: 3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl 3,4,5-trimethoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3643-2416
3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl 3,4,5-trimethoxybenzoate

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

3643-2416

Molecular Formula

C27H24O8 (C27 H24 O8)

Compound Name

3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl 3,4,5-trimethoxybenzoate

IUPAC name

3-(35-dimethylphenoxy)-4-oxo-4H-chromen-7-yl 345-trimethoxybenzoate

SMILES

Cc1cc(OC2=COc(cc(cc3)OC(c(cc4OC)cc(OC)c4OC)=O)c3C2=O)cc(C)c1

InChI

InChI=1S/C27H24O8/c1-15-8-16(2)10-19(9-15)34-24-14-33-21-13-18(6-7-20(21)25(24)28)35-27(29)17-11-22(30-3)26(32-5)23(12-17)31-4/h6-14H,1-5H3

InChI Key

LGTOCSHNUOISTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02350655

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.433

Distribution Coefficient, logD

4.433

Water Solubility, LogSw

-4.57

Polar Surface Area

70.926

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

3643-2416 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with 3643-2416 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3643-2416?
Check Price and Availability of 3643-2416, 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 3643-2416 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3643-2416
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3643-2416
  • 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 3643-2416 available by request