C564-0183 Screening compound: 4-[(2-{[1,4'-bipiperidin]-1'-yl}-2-oxoethyl)sulfanyl]-1-ethyl-1,2-dihydroquinolin-2-one

C564-0183 Screening compound: 4-[(2-{[1,4'-bipiperidin]-1'-yl}-2-oxoethyl)sulfanyl]-1-ethyl-1,2-dihydroquinolin-2-one
C564-0183 Screening compound: 4-[(2-{[1,4'-bipiperidin]-1'-yl}-2-oxoethyl)sulfanyl]-1-ethyl-1,2-dihydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C564-0183
4-[(2-{[1,4'-bipiperidin]-1'-yl}-2-oxoethyl)sulfanyl]-1-ethyl-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

C564-0183

Molecular Formula

C23H31N3O2S (C23 H31 N3 O2 S)

Compound Name

4-[(2-{[1,4'-bipiperidin]-1'-yl}-2-oxoethyl)sulfanyl]-1-ethyl-1,2-dihydroquinolin-2-one

IUPAC name

4-[(2-{[14'-bipiperidin]-1'-yl}-2-oxoethyl)sulfanyl]-1-ethyl-12-dihydroquinolin-2-one

SMILES

CCN(c(cccc1)c1C(SCC(N(CC1)CCC1N1CCCCC1)=O)=C1)C1=O

InChI

InChI=1S/C23H31N3O2S/c1-2-26-20-9-5-4-8-19(20)21(16-22(26)27)29-17-23(28)25-14-10-18(11-15-25)24-12-6-3-7-13-24/h4-5,8-9,16,18H,2-3,6-7,10-15,17H2,1H3

InChI Key

GMVUONGHKMZGAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14772280

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.825

Distribution Coefficient, logD

-0.730

Water Solubility, LogSw

-3.51

Polar Surface Area

34.829

Acid Dissociation Constant (pKa)

27.55

Base Dissociation Constant (pKb)

10.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.50

C564-0183 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C564-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C564-0183?
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What is the minimum amount of C564-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C564-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C564-0183
  • 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 C564-0183 available by request