D060-0091 Screening compound: 4-methyl-2-oxo-2H-chromen-7-yl 2-methylpropanoate

D060-0091 Screening compound: 4-methyl-2-oxo-2H-chromen-7-yl 2-methylpropanoate
D060-0091 Screening compound: 4-methyl-2-oxo-2H-chromen-7-yl 2-methylpropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D060-0091
4-methyl-2-oxo-2H-chromen-7-yl 2-methylpropanoate

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

D060-0091

Molecular Formula

C14H14O4 (C14 H14 O4)

Compound Name

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

IUPAC name

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

SMILES

CC(C)C(Oc(cc1)cc(O2)c1C(C)=CC2=O)=O

InChI

InChI=1S/C14H14O4/c1-8(2)14(16)17-10-4-5-11-9(3)6-13(15)18-12(11)7-10/h4-8H,1-3H3

InChI Key

YHKLRONIWKBAQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00441407

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

246.26

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.639

Distribution Coefficient, logD

2.639

Water Solubility, LogSw

-3.18

Polar Surface Area

41.295

Acid Dissociation Constant (pKa)

20.95

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

D060-0091 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Fragments Library (11262 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
Structure:
  • Fragments
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D060-0091 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D060-0091?
Check Price and Availability of D060-0091, 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 D060-0091 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D060-0091
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D060-0091
  • 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 D060-0091 available by request