C066-3122 Screening compound: 4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethoxy]-1-ethyl-2(1H)-quinolinone

C066-3122 Screening compound: 4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethoxy]-1-ethyl-2(1H)-quinolinone
C066-3122 Screening compound: 4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethoxy]-1-ethyl-2(1H)-quinolinone alternative view

Chemical Structure Depiction of ChemDiv screening compound C066-3122
4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethoxy]-1-ethyl-2(1H)-quinolinone

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

C066-3122

Molecular Formula

C21H20N2O3 (C21 H20 N2 O3)

Compound Name

4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethoxy]-1-ethyl-2(1H)-quinolinone

IUPAC name

n/a

SMILES

CCN(c(cccc1)c1C(OCC(N(CC1)c2c1cccc2)=O)=C1)C1=O

InChI

InChI=1S/C21H20N2O3/c1-2-22-18-10-6-4-8-16(18)19(13-20(22)24)26-14-21(25)23-12-11-15-7-3-5-9-17(15)23/h3-10,13H,2,11-12,14H2,1H3

InChI Key

VLHZGZWUUIFANR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14715511

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.4

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

2.705

Distribution Coefficient, logD

2.705

Water Solubility, LogSw

-3.26

Polar Surface Area

37.956

Acid Dissociation Constant (pKa)

25.71

Base Dissociation Constant (pKb)

-0.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

C066-3122 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C066-3122 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C066-3122?
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What is the minimum amount of C066-3122 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C066-3122
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C066-3122
  • 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 C066-3122 available by request