G678-0418 Screening compound: 2-(2-fluorophenoxy)-N-(2-{[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl}ethyl)acetamide

G678-0418 Screening compound: 2-(2-fluorophenoxy)-N-(2-{[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl}ethyl)acetamide
G678-0418 Screening compound: 2-(2-fluorophenoxy)-N-(2-{[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl}ethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G678-0418
2-(2-fluorophenoxy)-N-(2-{[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl}ethyl)acetamide

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

G678-0418

Molecular Formula

C21H26FN3O5S (C21 H26 FN3 O5 S)

Compound Name

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

IUPAC name

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

SMILES

COc(cc1)ccc1N(CC1)CCN1S(CCNC(COc(cccc1)c1F)=O)(=O)=O

InChI

InChI=1S/C21H26FN3O5S/c1-29-18-8-6-17(7-9-18)24-11-13-25(14-12-24)31(27,28)15-10-23-21(26)16-30-20-5-3-2-4-19(20)22/h2-9H,10-16H2,1H3,(H,23,26)

InChI Key

YMCZFBOPYCIPBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08319580

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.612

Distribution Coefficient, logD

1.612

Water Solubility, LogSw

-2.40

Polar Surface Area

74.547

Acid Dissociation Constant (pKa)

15.26

Base Dissociation Constant (pKb)

3.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

G678-0418 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 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 G678-0418 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G678-0418?
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What is the minimum amount of G678-0418 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G678-0418
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G678-0418
  • 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 G678-0418 available by request