G944-0069 Screening compound: 1-methyl-5-[5-(2-methylphenyl)-1,2,4-oxadiazol-3-yl]-1H-1,2,3-benzotriazole

G944-0069 Screening compound: 1-methyl-5-[5-(2-methylphenyl)-1,2,4-oxadiazol-3-yl]-1H-1,2,3-benzotriazole
G944-0069 Screening compound: 1-methyl-5-[5-(2-methylphenyl)-1,2,4-oxadiazol-3-yl]-1H-1,2,3-benzotriazole alternative view

Chemical Structure Depiction of ChemDiv screening compound G944-0069
1-methyl-5-[5-(2-methylphenyl)-1,2,4-oxadiazol-3-yl]-1H-1,2,3-benzotriazole

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

G944-0069

Molecular Formula

C16H13N5O (C16 H13 N5 O)

Compound Name

1-methyl-5-[5-(2-methylphenyl)-1,2,4-oxadiazol-3-yl]-1H-1,2,3-benzotriazole

IUPAC name

1-methyl-5-[5-(2-methylphenyl)-124-oxadiazol-3-yl]-1H-123-benzotriazole

SMILES

Cc(cccc1)c1-c1nc(-c(cc2)cc3c2n(C)nn3)no1

InChI

InChI=1S/C16H13N5O/c1-10-5-3-4-6-12(10)16-17-15(19-22-16)11-7-8-14-13(9-11)18-20-21(14)2/h3-9H,1-2H3

InChI Key

CZFOMPXSYAROBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27169143

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

291.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.342

Distribution Coefficient, logD

3.342

Water Solubility, LogSw

-3.56

Polar Surface Area

57.628

Acid Dissociation Constant (pKa)

27.73

Base Dissociation Constant (pKb)

0.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

G944-0069 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Protein-Protein Interaction Library (218420 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G944-0069 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G944-0069?
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What is the minimum amount of G944-0069 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G944-0069
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G944-0069
  • 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 G944-0069 available by request