G678-0549 Screening compound: 3-(4-methoxyphenyl)-N-(2-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}ethyl)propanamide

G678-0549 Screening compound: 3-(4-methoxyphenyl)-N-(2-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}ethyl)propanamide
G678-0549 Screening compound: 3-(4-methoxyphenyl)-N-(2-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}ethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G678-0549
3-(4-methoxyphenyl)-N-(2-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}ethyl)propanamide

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

G678-0549

Molecular Formula

C23H31N3O5S (C23 H31 N3 O5 S)

Compound Name

3-(4-methoxyphenyl)-N-(2-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}ethyl)propanamide

IUPAC name

3-(4-methoxyphenyl)-N-(2-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}ethyl)propanamide

SMILES

COc1ccc(CCC(NCCS(N(CC2)CCN2c(cccc2)c2OC)(=O)=O)=O)cc1

InChI

InChI=1S/C23H31N3O5S/c1-30-20-10-7-19(8-11-20)9-12-23(27)24-13-18-32(28,29)26-16-14-25(15-17-26)21-5-3-4-6-22(21)31-2/h3-8,10-11H,9,12-18H2,1-2H3,(H,24,27)

InChI Key

HOJDDYGJUZIWJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08319687

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.931

Distribution Coefficient, logD

1.931

Water Solubility, LogSw

-2.55

Polar Surface Area

74.290

Acid Dissociation Constant (pKa)

14.71

Base Dissociation Constant (pKb)

5.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

G678-0549 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Selective Target Activity Profiling Library (14702 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

References: we are preparing a list of scientific research reports with G678-0549 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G678-0549?
Check Price and Availability of G678-0549, 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 G678-0549 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G678-0549
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G678-0549
  • 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 G678-0549 available by request