G718-0696 Screening compound: N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-methoxybenzene-1-sulfonamide

G718-0696 Screening compound: N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-methoxybenzene-1-sulfonamide
G718-0696 Screening compound: N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-methoxybenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G718-0696
N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-methoxybenzene-1-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

G718-0696

Molecular Formula

C17H17ClN4O3S (C17 H17 ClN4 O3 S)

Compound Name

N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-methoxybenzene-1-sulfonamide

IUPAC name

N-{2-[5-(4-chlorophenyl)-1H-124-triazol-3-yl]ethyl}-4-methoxybenzene-1-sulfonamide

SMILES

COc(cc1)ccc1S(NCCc1n[nH]c(-c(cc2)ccc2Cl)n1)(=O)=O

InChI

InChI=1S/C17H17ClN4O3S/c1-25-14-6-8-15(9-7-14)26(23,24)19-11-10-16-20-17(22-21-16)12-2-4-13(18)5-3-12/h2-9,19H,10-11H2,1H3,(H,20,21,22)

InChI Key

ROIOSYQKMQVNEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27153780

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.87

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.628

Distribution Coefficient, logD

3.616

Water Solubility, LogSw

-4.30

Polar Surface Area

84.157

Acid Dissociation Constant (pKa)

8.94

Base Dissociation Constant (pKb)

0.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

G718-0696 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • Nuclear receptors

References: we are preparing a list of scientific research reports with G718-0696 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G718-0696?
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What is the minimum amount of G718-0696 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G718-0696
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G718-0696
  • 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 G718-0696 available by request