G766-1231 Screening compound: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-({3-[(4-methylphenyl)methyl]quinoxalin-2-yl}sulfanyl)ethan-1-one

G766-1231 Screening compound: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-({3-[(4-methylphenyl)methyl]quinoxalin-2-yl}sulfanyl)ethan-1-one
G766-1231 Screening compound: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-({3-[(4-methylphenyl)methyl]quinoxalin-2-yl}sulfanyl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G766-1231
1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-({3-[(4-methylphenyl)methyl]quinoxalin-2-yl}sulfanyl)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

G766-1231

Molecular Formula

C29H30N4O2S (C29 H30 N4 O2 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1ccc(Cc2nc3ccccc3nc2SCC(N(CC2)CCN2c(cccc2)c2OC)=O)cc1

InChI

InChI=1S/C29H30N4O2S/c1-21-11-13-22(14-12-21)19-25-29(31-24-8-4-3-7-23(24)30-25)36-20-28(34)33-17-15-32(16-18-33)26-9-5-6-10-27(26)35-2/h3-14H,15-20H2,1-2H3

InChI Key

QVLPYVDUEXXIGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15034505

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.65

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.560

Distribution Coefficient, logD

5.560

Water Solubility, LogSw

-5.44

Polar Surface Area

45.008

Acid Dissociation Constant (pKa)

21.14

Base Dissociation Constant (pKb)

3.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.60

G766-1231 in Drug Discovery

Included in Screening Libraries

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

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G766-1231 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G766-1231?
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What is the minimum amount of G766-1231 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G766-1231
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G766-1231
  • 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 G766-1231 available by request