C547-0521 Screening compound: 1-ethyl-4-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethoxy]-1,2-dihydroquinolin-2-one

C547-0521 Screening compound: 1-ethyl-4-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethoxy]-1,2-dihydroquinolin-2-one
C547-0521 Screening compound: 1-ethyl-4-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethoxy]-1,2-dihydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C547-0521
1-ethyl-4-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethoxy]-1,2-dihydroquinolin-2-one

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

C547-0521

Molecular Formula

C22H22N2O3 (C22 H22 N2 O3)

Compound Name

1-ethyl-4-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethoxy]-1,2-dihydroquinolin-2-one

IUPAC name

1-ethyl-4-[2-oxo-2-(1234-tetrahydroquinolin-1-yl)ethoxy]-12-dihydroquinolin-2-one

SMILES

CCN(c(cccc1)c1C(OCC(N(CCC1)c2c1cccc2)=O)=C1)C1=O

InChI

InChI=1S/C22H22N2O3/c1-2-23-19-12-6-4-10-17(19)20(14-21(23)25)27-15-22(26)24-13-7-9-16-8-3-5-11-18(16)24/h3-6,8,10-12,14H,2,7,9,13,15H2,1H3

InChI Key

DGTRCYCPQXNIQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14769015

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.040

Distribution Coefficient, logD

3.040

Water Solubility, LogSw

-3.56

Polar Surface Area

37.590

Acid Dissociation Constant (pKa)

25.98

Base Dissociation Constant (pKb)

-0.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

C547-0521 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C547-0521 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C547-0521?
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What is the minimum amount of C547-0521 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C547-0521
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C547-0521
  • 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 C547-0521 available by request