G856-4084 Screening compound: N-[2-(2H-1,3-benzodioxol-5-yl)-2-(morpholin-4-yl)ethyl]-N'-[2-(3,4-dimethoxyphenyl)ethyl]ethanediamide

G856-4084 Screening compound: N-[2-(2H-1,3-benzodioxol-5-yl)-2-(morpholin-4-yl)ethyl]-N'-[2-(3,4-dimethoxyphenyl)ethyl]ethanediamide
G856-4084 Screening compound: N-[2-(2H-1,3-benzodioxol-5-yl)-2-(morpholin-4-yl)ethyl]-N'-[2-(3,4-dimethoxyphenyl)ethyl]ethanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-4084
N-[2-(2H-1,3-benzodioxol-5-yl)-2-(morpholin-4-yl)ethyl]-N'-[2-(3,4-dimethoxyphenyl)ethyl]ethanediamide

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

G856-4084

Molecular Formula

C25H31N3O7 (C25 H31 N3 O7)

Compound Name

N-[2-(2H-1,3-benzodioxol-5-yl)-2-(morpholin-4-yl)ethyl]-N'-[2-(3,4-dimethoxyphenyl)ethyl]ethanediamide

IUPAC name

N-[2-(2H-13-benzodioxol-5-yl)-2-(morpholin-4-yl)ethyl]-N'-[2-(34-dimethoxyphenyl)ethyl]ethanediamide

SMILES

COc(ccc(CCNC(C(NCC(c(cc1)cc2c1OCO2)N1CCOCC1)=O)=O)c1)c1OC

InChI

InChI=1S/C25H31N3O7/c1-31-20-5-3-17(13-22(20)32-2)7-8-26-24(29)25(30)27-15-19(28-9-11-33-12-10-28)18-4-6-21-23(14-18)35-16-34-21/h3-6,13-14,19H,7-12,15-16H2,1-2H3,(H,26,29)(H,27,30)/t19-/m0/s1

InChI Key

KEVFFXONQMIJCO-IBGZPJMESA-N

MDL Number (MFCD)

MFCD07192586

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.062

Distribution Coefficient, logD

1.008

Water Solubility, LogSw

-2.10

Polar Surface Area

92.452

Acid Dissociation Constant (pKa)

8.58

Base Dissociation Constant (pKb)

6.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.00

G856-4084 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

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

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with G856-4084 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-4084?
Check Price and Availability of G856-4084, 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 G856-4084 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-4084
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-4084
  • 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 G856-4084 available by request