G945-0173 Screening compound: N-{1-[3-(1-ethyl-1H-1,3-benzodiazol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide

G945-0173 Screening compound: N-{1-[3-(1-ethyl-1H-1,3-benzodiazol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide
G945-0173 Screening compound: N-{1-[3-(1-ethyl-1H-1,3-benzodiazol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G945-0173
N-{1-[3-(1-ethyl-1H-1,3-benzodiazol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-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

G945-0173

Molecular Formula

C20H21N5O3S (C20 H21 N5 O3 S)

Compound Name

N-{1-[3-(1-ethyl-1H-1,3-benzodiazol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide

IUPAC name

N-{1-[3-(1-ethyl-1H-13-benzodiazol-5-yl)-124-oxadiazol-5-yl]ethyl}-4-methylbenzene-1-sulfonamide

SMILES

CCn1c(ccc(-c2noc(C(C)NS(c3ccc(C)cc3)(=O)=O)n2)c2)c2nc1

InChI

InChI=1S/C20H21N5O3S/c1-4-25-12-21-17-11-15(7-10-18(17)25)19-22-20(28-23-19)14(3)24-29(26,27)16-8-5-13(2)6-9-16/h5-12,14,24H,4H2,1-3H3/t14-/m0/s1

InChI Key

TWZRDUNJHURJBL-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27169432

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.976

Distribution Coefficient, logD

3.890

Water Solubility, LogSw

-3.98

Polar Surface Area

83.232

Acid Dissociation Constant (pKa)

8.06

Base Dissociation Constant (pKb)

3.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

G945-0173 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Antiviral Library (67538 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Antibacterial Compounds Library (13827 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with G945-0173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G945-0173?
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What is the minimum amount of G945-0173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G945-0173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G945-0173
  • 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 G945-0173 available by request