K677-0007 Screening compound: 6-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate

K677-0007 Screening compound: 6-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate
K677-0007 Screening compound: 6-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound K677-0007
6-chloro-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

K677-0007

Molecular Formula

C12H9ClO4 (C12 H9 ClO4)

Compound Name

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

IUPAC name

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

SMILES

CC(Oc(cc(c(C(C)=C1)c2)OC1=O)c2Cl)=O

InChI

InChI=1S/C12H9ClO4/c1-6-3-12(15)17-10-5-11(16-7(2)14)9(13)4-8(6)10/h3-5H,1-2H3

InChI Key

STZWZDDYVDAWDQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01553845

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

252.65

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

2.313

Distribution Coefficient, logD

2.313

Water Solubility, LogSw

-3.17

Polar Surface Area

41.483

Acid Dissociation Constant (pKa)

22.43

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

K677-0007 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Fragments Library (11262 compounds)

STING Agonist Library (5895 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
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with K677-0007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K677-0007?
Check Price and Availability of K677-0007, 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 K677-0007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K677-0007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K677-0007
  • 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 K677-0007 available by request