4695-2452 Screening compound: 2-[4-(benzyloxy)phenyl]-2-oxoethyl 2-(acetyloxy)benzoate

4695-2452 Screening compound: 2-[4-(benzyloxy)phenyl]-2-oxoethyl 2-(acetyloxy)benzoate
4695-2452 Screening compound: 2-[4-(benzyloxy)phenyl]-2-oxoethyl 2-(acetyloxy)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4695-2452
2-[4-(benzyloxy)phenyl]-2-oxoethyl 2-(acetyloxy)benzoate

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

4695-2452

Molecular Formula

C24H20O6 (C24 H20 O6)

Compound Name

2-[4-(benzyloxy)phenyl]-2-oxoethyl 2-(acetyloxy)benzoate

IUPAC name

2-[4-(benzyloxy)phenyl]-2-oxoethyl 2-(acetyloxy)benzoate

SMILES

CC(Oc(cccc1)c1C(OCC(c(cc1)ccc1OCc1ccccc1)=O)=O)=O

InChI

InChI=1S/C24H20O6/c1-17(25)30-23-10-6-5-9-21(23)24(27)29-16-22(26)19-11-13-20(14-12-19)28-15-18-7-3-2-4-8-18/h2-14H,15-16H2,1H3

InChI Key

MQTRBAWMLGFNEA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02188936

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.42

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.056

Distribution Coefficient, logD

4.056

Water Solubility, LogSw

-4.56

Polar Surface Area

62.408

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

4695-2452 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 4695-2452 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4695-2452?
Check Price and Availability of 4695-2452, 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 4695-2452 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4695-2452
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4695-2452
  • 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 4695-2452 available by request