1682-2683 Screening compound: 4-methyl-2-oxo-2H-chromen-7-yl 2-phenoxyacetate

1682-2683 Screening compound: 4-methyl-2-oxo-2H-chromen-7-yl 2-phenoxyacetate
1682-2683 Screening compound: 4-methyl-2-oxo-2H-chromen-7-yl 2-phenoxyacetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-2683
4-methyl-2-oxo-2H-chromen-7-yl 2-phenoxyacetate

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

1682-2683

Molecular Formula

C18H14O5 (C18 H14 O5)

Compound Name

4-methyl-2-oxo-2H-chromen-7-yl 2-phenoxyacetate

IUPAC name

4-methyl-2-oxo-2H-chromen-7-yl 2-phenoxyacetate

SMILES

CC(c(ccc(OC(COc1ccccc1)=O)c1)c1O1)=CC1=O

InChI

InChI=1S/C18H14O5/c1-12-9-17(19)23-16-10-14(7-8-15(12)16)22-18(20)11-21-13-5-3-2-4-6-13/h2-10H,11H2,1H3

InChI Key

FBLPHDDHVQCVSD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00573340

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.745

Distribution Coefficient, logD

2.745

Water Solubility, LogSw

-3.34

Polar Surface Area

47.928

Acid Dissociation Constant (pKa)

23.27

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

1682-2683 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Frequent Hitters Library (7624 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Kinases
  • Others
Structure:
  • Pool
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 1682-2683 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-2683?
Check Price and Availability of 1682-2683, 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 1682-2683 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-2683
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-2683
  • 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 1682-2683 available by request