8006-9174 Screening compound: 6-NITRO-1,3-BENZODIOXOLE-5-CARBALDEHYDE 5-[6-(2-METHOXYANILINO)[1,2,5]OXADIAZOLO[3,4-B]PYRAZIN-5-YL]HYDRAZONE

8006-9174 Screening compound: 6-NITRO-1,3-BENZODIOXOLE-5-CARBALDEHYDE 5-[6-(2-METHOXYANILINO)[1,2,5]OXADIAZOLO[3,4-B]PYRAZIN-5-YL]HYDRAZONE
8006-9174 Screening compound: 6-NITRO-1,3-BENZODIOXOLE-5-CARBALDEHYDE 5-[6-(2-METHOXYANILINO)[1,2,5]OXADIAZOLO[3,4-B]PYRAZIN-5-YL]HYDRAZONE alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-9174
6-NITRO-1,3-BENZODIOXOLE-5-CARBALDEHYDE 5-[6-(2-METHOXYANILINO)[1,2,5]OXADIAZOLO[3,4-B]PYRAZIN-5-YL]HYDRAZONE

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

8006-9174

Molecular Formula

C19H14N8O6 (C19 H14 N8 O6)

Compound Name

6-NITRO-1,3-BENZODIOXOLE-5-CARBALDEHYDE 5-[6-(2-METHOXYANILINO)[1,2,5]OXADIAZOLO[3,4-B]PYRAZIN-5-YL]HYDRAZONE

IUPAC name

n/a

SMILES

COc(cccc1)c1Nc1nc2nonc2nc1N/N=C/c(cc1OCOc1c1)c1[N+]([O-])=O

InChI

InChI=1S/C19H14N8O6/c1-30-13-5-3-2-4-11(13)21-16-17(23-19-18(22-16)25-33-26-19)24-20-8-10-6-14-15(32-9-31-14)7-12(10)27(28)29/h2-8H,9H2,1H3,(H,21,22,25)(H,23,24,26)

InChI Key

GXOMFKDRUIRAGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00657432

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.37

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

14

Partition Coefficient, logP

4.491

Distribution Coefficient, logD

4.491

Water Solubility, LogSw

-4.40

Polar Surface Area

143.899

Acid Dissociation Constant (pKa)

11.09

Base Dissociation Constant (pKb)

0.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with 8006-9174 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-9174?
Check Price and Availability of 8006-9174, 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 8006-9174 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-9174
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-9174
  • 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 8006-9174 available by request