6937-0106 Screening compound: 5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1-phenyl-1H-1,2,3,4-tetrazole

6937-0106 Screening compound: 5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1-phenyl-1H-1,2,3,4-tetrazole
6937-0106 Screening compound: 5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1-phenyl-1H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 6937-0106
5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1-phenyl-1H-1,2,3,4-tetrazole

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

6937-0106

Molecular Formula

C10H8N8O2S (C10 H8 N8 O2 S)

Compound Name

5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1-phenyl-1H-1,2,3,4-tetrazole

IUPAC name

5-[(1-methyl-3-nitro-1H-124-triazol-5-yl)sulfanyl]-1-phenyl-1H-1234-tetrazole

SMILES

Cn(c(Sc1nnnn1-c1ccccc1)n1)nc1[N+]([O-])=O

InChI

InChI=1S/C10H8N8O2S/c1-16-9(11-8(13-16)18(19)20)21-10-12-14-15-17(10)7-5-3-2-4-6-7/h2-6H,1H3

InChI Key

JWHHPGARBVYUFX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03248667

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.29

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.458

Distribution Coefficient, logD

1.458

Water Solubility, LogSw

-1.99

Polar Surface Area

97.123

Acid Dissociation Constant (pKa)

28.03

Base Dissociation Constant (pKb)

-2.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

6937-0106 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6937-0106 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6937-0106?
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What is the minimum amount of 6937-0106 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6937-0106
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6937-0106
  • 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 6937-0106 available by request