G766-1195 Screening compound: 2-({3-[(3-methoxyphenyl)methyl]quinoxalin-2-yl}sulfanyl)-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one

G766-1195 Screening compound: 2-({3-[(3-methoxyphenyl)methyl]quinoxalin-2-yl}sulfanyl)-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one
G766-1195 Screening compound: 2-({3-[(3-methoxyphenyl)methyl]quinoxalin-2-yl}sulfanyl)-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G766-1195
2-({3-[(3-methoxyphenyl)methyl]quinoxalin-2-yl}sulfanyl)-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

G766-1195

Molecular Formula

C27H25N3O2S (C27 H25 N3 O2 S)

Compound Name

2-({3-[(3-methoxyphenyl)methyl]quinoxalin-2-yl}sulfanyl)-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one

IUPAC name

2-({3-[(3-methoxyphenyl)methyl]quinoxalin-2-yl}sulfanyl)-1-(1234-tetrahydroquinolin-1-yl)ethan-1-one

SMILES

COc1cccc(Cc2nc3ccccc3nc2SCC(N(CCC2)c3c2cccc3)=O)c1

InChI

InChI=1S/C27H25N3O2S/c1-32-21-11-6-8-19(16-21)17-24-27(29-23-13-4-3-12-22(23)28-24)33-18-26(31)30-15-7-10-20-9-2-5-14-25(20)30/h2-6,8-9,11-14,16H,7,10,15,17-18H2,1H3

InChI Key

NDPRPARBMXAYCV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15034501

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.773

Distribution Coefficient, logD

5.773

Water Solubility, LogSw

-5.37

Polar Surface Area

40.626

Acid Dissociation Constant (pKa)

19.56

Base Dissociation Constant (pKb)

0.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

G766-1195 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

Human Kinases Annotated Library (2415 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
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G766-1195 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G766-1195?
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What is the minimum amount of G766-1195 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G766-1195
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G766-1195
  • 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 G766-1195 available by request