K780-0317 Screening compound: 4-methyl-2-oxo-2H-chromen-7-yl acetate

K780-0317 Screening compound: 4-methyl-2-oxo-2H-chromen-7-yl acetate
K780-0317 Screening compound: 4-methyl-2-oxo-2H-chromen-7-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound K780-0317
4-methyl-2-oxo-2H-chromen-7-yl 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

K780-0317

Molecular Formula

C12H10O4 (C12 H10 O4)

Compound Name

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

IUPAC name

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

SMILES

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

InChI

InChI=1S/C12H10O4/c1-7-5-12(14)16-11-6-9(15-8(2)13)3-4-10(7)11/h3-6H,1-2H3

InChI Key

HXVZGASCDAGAPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00006865

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

218.21

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.448

Distribution Coefficient, logD

1.448

Water Solubility, LogSw

-2.17

Polar Surface Area

41.397

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

K780-0317 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiparasite Library (23996 compounds)

Fragments Library (11262 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
  • Fragments
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K780-0317 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K780-0317?
Check Price and Availability of K780-0317, 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 K780-0317 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K780-0317
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K780-0317
  • 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 K780-0317 available by request