8010-5108 Screening compound: 8-methyl-9H-imidazo[4,5-e][1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazole-1,4-diium-1,4-diolate

8010-5108 Screening compound: 8-methyl-9H-imidazo[4,5-e][1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazole-1,4-diium-1,4-diolate
8010-5108 Screening compound: 8-methyl-9H-imidazo[4,5-e][1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazole-1,4-diium-1,4-diolate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-5108
8-methyl-9H-imidazo[4,5-e][1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazole-1,4-diium-1,4-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

8010-5108

Molecular Formula

C8H4N6O4 (C8 H4 N6 O4)

Compound Name

8-methyl-9H-imidazo[4,5-e][1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazole-1,4-diium-1,4-diolate

IUPAC name

14-methyl-49-dioxa-358101315-hexaazatetracyclo[10.3.0.0^{26}.0^{711}]pentadeca-1(12)2571013-hexaene-38-diium-38-bis(olate)

SMILES

Cc1nc(c2no[n+]([O-])c2c2no[n+]([O-])c22)c2[nH]1

InChI

InChI=1S/C8H4N6O4/c1-2-9-3-4(10-2)7-6(12-18-13(7)15)8-5(3)11-17-14(8)16/h1H3,(H,9,10)

InChI Key

WCBVREYYYFUYFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02110547

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

248.16

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.385

Distribution Coefficient, logD

0.385

Water Solubility, LogSw

-0.58

Polar Surface Area

102.502

Acid Dissociation Constant (pKa)

8.12

Base Dissociation Constant (pKb)

1.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with 8010-5108 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-5108?
Check Price and Availability of 8010-5108, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8010-5108 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-5108
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-5108
  • 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 8010-5108 available by request