8006-7201 Screening compound: N-[(E)-1-(2-furyl)methylidene]-N-(7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)amine

8006-7201 Screening compound: N-[(E)-1-(2-furyl)methylidene]-N-(7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)amine
8006-7201 Screening compound: N-[(E)-1-(2-furyl)methylidene]-N-(7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-7201
N-[(E)-1-(2-furyl)methylidene]-N-(7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)amine

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

8006-7201

Molecular Formula

C8H6N6O (C8 H6 N6 O)

Compound Name

N-[(E)-1-(2-furyl)methylidene]-N-(7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)amine

IUPAC name

(E)-1-(furan-2-yl)-N-{7H-[124]triazolo[43-b][124]triazol-3-yl}methanimine

SMILES

C(c1ccco1)=N/c1nnc2n1nc[nH]2

InChI

InChI=1S/C8H6N6O/c1-2-6(15-3-1)4-9-7-12-13-8-10-5-11-14(7)8/h1-5H,(H,10,11,13)

InChI Key

PWODXQSNWIWMFQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00826383

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

202.18

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.075

Distribution Coefficient, logD

-0.543

Water Solubility, LogSw

-1.40

Polar Surface Area

63.795

Acid Dissociation Constant (pKa)

7.11

Base Dissociation Constant (pKb)

3.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8006-7201 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 8006-7201 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-7201?
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What is the minimum amount of 8006-7201 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-7201
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-7201
  • 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 8006-7201 available by request