G718-0694 Screening compound: N-{2-[5-(4-CHLOROPHENYL)-1H-1,2,4-TRIAZOL-3-YL]ETHYL}-2,4,6-TRIMETHYLBENZENE-1-SULFONAMIDE

G718-0694 Screening compound: N-{2-[5-(4-CHLOROPHENYL)-1H-1,2,4-TRIAZOL-3-YL]ETHYL}-2,4,6-TRIMETHYLBENZENE-1-SULFONAMIDE
G718-0694 Screening compound: N-{2-[5-(4-CHLOROPHENYL)-1H-1,2,4-TRIAZOL-3-YL]ETHYL}-2,4,6-TRIMETHYLBENZENE-1-SULFONAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound G718-0694
N-{2-[5-(4-CHLOROPHENYL)-1H-1,2,4-TRIAZOL-3-YL]ETHYL}-2,4,6-TRIMETHYLBENZENE-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

G718-0694

Molecular Formula

C19H21ClN4O2S (C19 H21 ClN4 O2 S)

Compound Name

N-{2-[5-(4-CHLOROPHENYL)-1H-1,2,4-TRIAZOL-3-YL]ETHYL}-2,4,6-TRIMETHYLBENZENE-1-SULFONAMIDE

IUPAC name

n/a

SMILES

Cc(cc1C)cc(C)c1S(NCCc1n[nH]c(-c(cc2)ccc2Cl)n1)(=O)=O

InChI

InChI=1S/C19H21ClN4O2S/c1-12-10-13(2)18(14(3)11-12)27(25,26)21-9-8-17-22-19(24-23-17)15-4-6-16(20)7-5-15/h4-7,10-11,21H,8-9H2,1-3H3,(H,22,23,24)

InChI Key

FQRQDQKXKIKUOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27153779

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.92

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.865

Distribution Coefficient, logD

4.852

Water Solubility, LogSw

-4.82

Polar Surface Area

76.614

Acid Dissociation Constant (pKa)

8.94

Base Dissociation Constant (pKb)

0.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

G718-0694 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G718-0694 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G718-0694?
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What is the minimum amount of G718-0694 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G718-0694
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G718-0694
  • 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 G718-0694 available by request