6570-0118 Screening compound: 4-(ethoxycarbonyl)-1-[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]pyridin-1-ium

6570-0118 Screening compound: 4-(ethoxycarbonyl)-1-[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]pyridin-1-ium
6570-0118 Screening compound: 4-(ethoxycarbonyl)-1-[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]pyridin-1-ium alternative view

Chemical Structure Depiction of ChemDiv screening compound 6570-0118
4-(ethoxycarbonyl)-1-[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]pyridin-1-ium

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

6570-0118

Molecular Formula

C19H16NO5 (C19 H16 NO5)

Compound Name

4-(ethoxycarbonyl)-1-[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]pyridin-1-ium

IUPAC name

4-(ethoxycarbonyl)-1-[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]pyridin-1-ium

SMILES

CCOC(c1cc[n+](CC(C2=Cc(cccc3)c3OC2=O)=O)cc1)=O

InChI

InChI=1S/C19H16NO5/c1-2-24-18(22)13-7-9-20(10-8-13)12-16(21)15-11-14-5-3-4-6-17(14)25-19(15)23/h3-11H,2,12H2,1H3/q+1

InChI Key

YCCGCGZHQFMNLA-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

Br-

Molecular Weight

338.34

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

2.727

Distribution Coefficient, logD

2.727

Water Solubility, LogSw

-3.00

Polar Surface Area

57.953

Acid Dissociation Constant (pKa)

19.74

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with 6570-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6570-0118?
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What is the minimum amount of 6570-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6570-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6570-0118
  • 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 6570-0118 available by request