K783-4758 Screening compound: ethyl 2-{[2-methyl-4-oxo-2-(pyridin-3-yl)-3,4-dihydro-2H-1-benzopyran-6-yl]oxy}acetate

K783-4758 Screening compound: ethyl 2-{[2-methyl-4-oxo-2-(pyridin-3-yl)-3,4-dihydro-2H-1-benzopyran-6-yl]oxy}acetate
K783-4758 Screening compound: ethyl 2-{[2-methyl-4-oxo-2-(pyridin-3-yl)-3,4-dihydro-2H-1-benzopyran-6-yl]oxy}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound K783-4758
ethyl 2-{[2-methyl-4-oxo-2-(pyridin-3-yl)-3,4-dihydro-2H-1-benzopyran-6-yl]oxy}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

K783-4758

Molecular Formula

C19H19NO5 (C19 H19 NO5)

Compound Name

ethyl 2-{[2-methyl-4-oxo-2-(pyridin-3-yl)-3,4-dihydro-2H-1-benzopyran-6-yl]oxy}acetate

IUPAC name

ethyl 2-{[2-methyl-4-oxo-2-(pyridin-3-yl)-34-dihydro-2H-1-benzopyran-6-yl]oxy}acetate

SMILES

CCOC(COc(cc1)cc(C(C2)=O)c1OC2(C)c1cnccc1)=O

InChI

InChI=1S/C19H19NO5/c1-3-23-18(22)12-24-14-6-7-17-15(9-14)16(21)10-19(2,25-17)13-5-4-8-20-11-13/h4-9,11H,3,10,12H2,1-2H3/t19-/m0/s1

InChI Key

MKTFDGBHXZCTPC-IBGZPJMESA-N

MDL Number (MFCD)

MFCD03830320

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.140

Distribution Coefficient, logD

2.140

Water Solubility, LogSw

-2.61

Polar Surface Area

56.675

Acid Dissociation Constant (pKa)

20.58

Base Dissociation Constant (pKb)

3.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

K783-4758 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K783-4758 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K783-4758?
Check Price and Availability of K783-4758, 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 K783-4758 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K783-4758
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K783-4758
  • 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 K783-4758 available by request