3473-3473 Screening compound: 7-(2,4-dichlorophenyl)-5,7-dihydro-4H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole-3,6-diium-3,6-diolate

3473-3473 Screening compound: 7-(2,4-dichlorophenyl)-5,7-dihydro-4H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole-3,6-diium-3,6-diolate
3473-3473 Screening compound: 7-(2,4-dichlorophenyl)-5,7-dihydro-4H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole-3,6-diium-3,6-diolate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3473-3473
7-(2,4-dichlorophenyl)-5,7-dihydro-4H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole-3,6-diium-3,6-diolate

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

3473-3473

Molecular Formula

C12H7Cl2N5O3 (C12 H7 Cl2 N5 O3)

Compound Name

7-(2,4-dichlorophenyl)-5,7-dihydro-4H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole-3,6-diium-3,6-diolate

IUPAC name

11-(24-dichlorophenyl)-4-oxa-35101112-pentaazatricyclo[7.3.0.0^{26}]dodeca-1(12)259-tetraene-510-diium-510-bis(olate)

SMILES

[O-][n+]1c(CCc2[n+]([O-])onc2-2)c2nn1-c(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C12H7Cl2N5O3/c13-6-1-2-8(7(14)5-6)17-15-11-9(18(17)20)3-4-10-12(11)16-22-19(10)21/h1-2,5H,3-4H2

InChI Key

ASWRNOPACHSUJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02031408

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.12

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.675

Distribution Coefficient, logD

2.675

Water Solubility, LogSw

-3.41

Polar Surface Area

76.456

Acid Dissociation Constant (pKa)

21.51

Base Dissociation Constant (pKb)

-3.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

3473-3473 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3473-3473 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3473-3473?
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What is the minimum amount of 3473-3473 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3473-3473
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3473-3473
  • 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 3473-3473 available by request