G862-0758 Screening compound: 2-[(2-{[(4-fluorophenyl)sulfanyl]methyl}-5-methoxypyridin-4-yl)oxy]-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one

G862-0758 Screening compound: 2-[(2-{[(4-fluorophenyl)sulfanyl]methyl}-5-methoxypyridin-4-yl)oxy]-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one
G862-0758 Screening compound: 2-[(2-{[(4-fluorophenyl)sulfanyl]methyl}-5-methoxypyridin-4-yl)oxy]-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G862-0758
2-[(2-{[(4-fluorophenyl)sulfanyl]methyl}-5-methoxypyridin-4-yl)oxy]-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-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

G862-0758

Molecular Formula

C24H23FN2O3S (C24 H23 FN2 O3 S)

Compound Name

2-[(2-{[(4-fluorophenyl)sulfanyl]methyl}-5-methoxypyridin-4-yl)oxy]-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one

IUPAC name

2-[(2-{[(4-fluorophenyl)sulfanyl]methyl}-5-methoxypyridin-4-yl)oxy]-1-(1234-tetrahydroquinolin-1-yl)ethan-1-one

SMILES

COc1cnc(CSc(cc2)ccc2F)cc1OCC(N(CCC1)c2c1cccc2)=O

InChI

InChI=1S/C24H23FN2O3S/c1-29-23-14-26-19(16-31-20-10-8-18(25)9-11-20)13-22(23)30-15-24(28)27-12-4-6-17-5-2-3-7-21(17)27/h2-3,5,7-11,13-14H,4,6,12,15-16H2,1H3

InChI Key

NIPJYFNACIVLHA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15072464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.261

Distribution Coefficient, logD

4.261

Water Solubility, LogSw

-4.16

Polar Surface Area

39.601

Acid Dissociation Constant (pKa)

22.19

Base Dissociation Constant (pKb)

2.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G862-0758 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G862-0758 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G862-0758?
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What is the minimum amount of G862-0758 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G862-0758
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G862-0758
  • 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 G862-0758 available by request