K979-0459 Screening compound: methyl 2-({4-oxo-4H-thieno[3,2-c]chromen-2-yl}formamido)acetate

K979-0459 Screening compound: methyl 2-({4-oxo-4H-thieno[3,2-c]chromen-2-yl}formamido)acetate
K979-0459 Screening compound: methyl 2-({4-oxo-4H-thieno[3,2-c]chromen-2-yl}formamido)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound K979-0459
methyl 2-({4-oxo-4H-thieno[3,2-c]chromen-2-yl}formamido)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

K979-0459

Molecular Formula

C15H11NO5S (C15 H11 NO5 S)

Compound Name

methyl 2-({4-oxo-4H-thieno[3,2-c]chromen-2-yl}formamido)acetate

IUPAC name

methyl 2-({4-oxo-4H-thieno[32-c]chromen-2-yl}formamido)acetate

SMILES

COC(CNC(c1cc(C(Oc2c-3cccc2)=O)c3s1)=O)=O

InChI

InChI=1S/C15H11NO5S/c1-20-12(17)7-16-14(18)11-6-9-13(22-11)8-4-2-3-5-10(8)21-15(9)19/h2-6H,7H2,1H3,(H,16,18)

InChI Key

WCPYQGHFHBGWPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15115797

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.32

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.202

Distribution Coefficient, logD

2.202

Water Solubility, LogSw

-3.00

Polar Surface Area

67.171

Acid Dissociation Constant (pKa)

13.41

Base Dissociation Constant (pKb)

-5.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

K979-0459 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with K979-0459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K979-0459?
Check Price and Availability of K979-0459, 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 K979-0459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K979-0459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K979-0459
  • 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 K979-0459 available by request