4270-0399 Screening compound: ETHYL 2-[(8-BENZOYL-4-METHYL-2-OXO-2H-CHROMEN-7-YL)OXY]ACETATE

4270-0399 Screening compound: ETHYL 2-[(8-BENZOYL-4-METHYL-2-OXO-2H-CHROMEN-7-YL)OXY]ACETATE
4270-0399 Screening compound: ETHYL 2-[(8-BENZOYL-4-METHYL-2-OXO-2H-CHROMEN-7-YL)OXY]ACETATE alternative view

Chemical Structure Depiction of ChemDiv screening compound 4270-0399
ETHYL 2-[(8-BENZOYL-4-METHYL-2-OXO-2H-CHROMEN-7-YL)OXY]ACETATE

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

4270-0399

Molecular Formula

C21H18O6 (C21 H18 O6)

Compound Name

ETHYL 2-[(8-BENZOYL-4-METHYL-2-OXO-2H-CHROMEN-7-YL)OXY]ACETATE

IUPAC name

n/a

SMILES

CCOC(COc1ccc(C(C)=CC(O2)=O)c2c1C(c1ccccc1)=O)=O

InChI

InChI=1S/C21H18O6/c1-3-25-18(23)12-26-16-10-9-15-13(2)11-17(22)27-21(15)19(16)20(24)14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3

InChI Key

KVQHFSODRHHPPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02916687

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.37

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.161

Distribution Coefficient, logD

3.161

Water Solubility, LogSw

-3.45

Polar Surface Area

61.542

Acid Dissociation Constant (pKa)

24.85

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

4270-0399 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with 4270-0399 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4270-0399?
Check Price and Availability of 4270-0399, 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 4270-0399 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4270-0399
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4270-0399
  • 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 4270-0399 available by request