C547-0219 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]acetamide

C547-0219 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]acetamide
C547-0219 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C547-0219
N-[(2-chloro-4-fluorophenyl)methyl]-2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]acetamide

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

C547-0219

Molecular Formula

C19H16ClFN2O3 (C19 H16 ClFN2 O3)

Compound Name

N-[(2-chloro-4-fluorophenyl)methyl]-2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]acetamide

IUPAC name

N-[(2-chloro-4-fluorophenyl)methyl]-2-[(1-methyl-2-oxo-12-dihydroquinolin-4-yl)oxy]acetamide

SMILES

CN(c(cccc1)c1C(OCC(NCc(ccc(F)c1)c1Cl)=O)=C1)C1=O

InChI

InChI=1S/C19H16ClFN2O3/c1-23-16-5-3-2-4-14(16)17(9-19(23)25)26-11-18(24)22-10-12-6-7-13(21)8-15(12)20/h2-9H,10-11H2,1H3,(H,22,24)

InChI Key

SXSACUGYRVKUIB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14768901

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.8

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.956

Distribution Coefficient, logD

2.956

Water Solubility, LogSw

-3.66

Polar Surface Area

47.046

Acid Dissociation Constant (pKa)

12.98

Base Dissociation Constant (pKb)

-3.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

C547-0219 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human Receptors Annotated Library (5376 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

References: we are preparing a list of scientific research reports with C547-0219 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C547-0219?
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What is the minimum amount of C547-0219 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C547-0219
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C547-0219
  • 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 C547-0219 available by request