G906-0466 Screening compound: [(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)(4-methylphenyl)sulfamoyl]dimethylamine

G906-0466 Screening compound: [(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)(4-methylphenyl)sulfamoyl]dimethylamine
G906-0466 Screening compound: [(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)(4-methylphenyl)sulfamoyl]dimethylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound G906-0466
[(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)(4-methylphenyl)sulfamoyl]dimethylamine

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

G906-0466

Molecular Formula

C23H30N4O5S (C23 H30 N4 O5 S)

Compound Name

[(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)(4-methylphenyl)sulfamoyl]dimethylamine

IUPAC name

[(2-{4-[(2H-13-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)(4-methylphenyl)sulfamoyl]dimethylamine

SMILES

Cc(cc1)ccc1N(CC(N1CCN(Cc(cc2)cc3c2OCO3)CC1)=O)S(N(C)C)(=O)=O

InChI

InChI=1S/C23H30N4O5S/c1-18-4-7-20(8-5-18)27(33(29,30)24(2)3)16-23(28)26-12-10-25(11-13-26)15-19-6-9-21-22(14-19)32-17-31-21/h4-9,14H,10-13,15-17H2,1-3H3

InChI Key

MSBFVNGRJPUYLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27167242

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.58

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.922

Distribution Coefficient, logD

1.730

Water Solubility, LogSw

-2.80

Polar Surface Area

73.199

Acid Dissociation Constant (pKa)

20.99

Base Dissociation Constant (pKb)

7.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

G906-0466 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Immune system
Targets:
  • Proteases
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G906-0466 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G906-0466?
Check Price and Availability of G906-0466, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G906-0466 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G906-0466
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G906-0466
  • 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 G906-0466 available by request