G678-0708 Screening compound: N-(2-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}ethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

G678-0708 Screening compound: N-(2-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}ethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
G678-0708 Screening compound: N-(2-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}ethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G678-0708
N-(2-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}ethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

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

G678-0708

Molecular Formula

C20H24FN3O6S2 (C20 H24 FN3 O6 S2)

Compound Name

N-(2-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}ethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

IUPAC name

N-(2-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}ethyl)-23-dihydro-14-benzodioxine-6-sulfonamide

SMILES

O=S(CCNS(c(cc1)cc2c1OCCO2)(=O)=O)(N(CC1)CCN1c(cccc1)c1F)=O

InChI

InChI=1S/C20H24FN3O6S2/c21-17-3-1-2-4-18(17)23-8-10-24(11-9-23)31(25,26)14-7-22-32(27,28)16-5-6-19-20(15-16)30-13-12-29-19/h1-6,15,22H,7-14H2

InChI Key

MLCFARUFMUCJLG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07803447

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.56

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.177

Distribution Coefficient, logD

1.177

Water Solubility, LogSw

-2.50

Polar Surface Area

92.498

Acid Dissociation Constant (pKa)

11.76

Base Dissociation Constant (pKb)

4.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

G678-0708 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

GPCR Targeted Library (31838 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G678-0708 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G678-0708?
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What is the minimum amount of G678-0708 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G678-0708
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G678-0708
  • 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 G678-0708 available by request