K219-0993 Screening compound: 1,4-dimethyl 2-(6-chloro-2-oxo-2H-chromene-3-amido)benzene-1,4-dicarboxylate

K219-0993 Screening compound: 1,4-dimethyl 2-(6-chloro-2-oxo-2H-chromene-3-amido)benzene-1,4-dicarboxylate
K219-0993 Screening compound: 1,4-dimethyl 2-(6-chloro-2-oxo-2H-chromene-3-amido)benzene-1,4-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K219-0993
1,4-dimethyl 2-(6-chloro-2-oxo-2H-chromene-3-amido)benzene-1,4-dicarboxylate

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

K219-0993

Molecular Formula

C20H14ClNO7 (C20 H14 ClNO7)

Compound Name

1,4-dimethyl 2-(6-chloro-2-oxo-2H-chromene-3-amido)benzene-1,4-dicarboxylate

IUPAC name

14-dimethyl 2-(6-chloro-2-oxo-2H-chromene-3-amido)benzene-14-dicarboxylate

SMILES

COC(c(cc1)cc(NC(C2=Cc(cc(cc3)Cl)c3OC2=O)=O)c1C(OC)=O)=O

InChI

InChI=1S/C20H14ClNO7/c1-27-18(24)10-3-5-13(19(25)28-2)15(9-10)22-17(23)14-8-11-7-12(21)4-6-16(11)29-20(14)26/h3-9H,1-2H3,(H,22,23)

InChI Key

RPBYZYXONZKHKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02088310

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.79

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.503

Distribution Coefficient, logD

1.521

Water Solubility, LogSw

-3.97

Polar Surface Area

85.901

Acid Dissociation Constant (pKa)

5.42

Base Dissociation Constant (pKb)

-4.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with K219-0993 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K219-0993?
Check Price and Availability of K219-0993, 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 K219-0993 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K219-0993
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K219-0993
  • 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 K219-0993 available by request