8006-9668 Screening compound: 4-(4-{1-[(E)-2-(9H-fluoren-9-yliden)hydrazono]ethyl}-5-methyl-1H-1,2,3-triazol-1-yl)-1,2,5-oxadiazol-3-amine

8006-9668 Screening compound: 4-(4-{1-[(E)-2-(9H-fluoren-9-yliden)hydrazono]ethyl}-5-methyl-1H-1,2,3-triazol-1-yl)-1,2,5-oxadiazol-3-amine
8006-9668 Screening compound: 4-(4-{1-[(E)-2-(9H-fluoren-9-yliden)hydrazono]ethyl}-5-methyl-1H-1,2,3-triazol-1-yl)-1,2,5-oxadiazol-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-9668
4-(4-{1-[(E)-2-(9H-fluoren-9-yliden)hydrazono]ethyl}-5-methyl-1H-1,2,3-triazol-1-yl)-1,2,5-oxadiazol-3-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

8006-9668

Molecular Formula

C20H16N8O (C20 H16 N8 O)

Compound Name

4-(4-{1-[(E)-2-(9H-fluoren-9-yliden)hydrazono]ethyl}-5-methyl-1H-1,2,3-triazol-1-yl)-1,2,5-oxadiazol-3-amine

IUPAC name

4-{4-[(1E)-1-[2-(9H-fluoren-9-ylidene)hydrazin-1-ylidene]ethyl]-5-methyl-1H-123-triazol-1-yl}-125-oxadiazol-3-amine

SMILES

C/C(/c1c(C)n(-c2nonc2N)nn1)=N\N=C1c(cccc2)c2-c2c1cccc2

InChI

InChI=1S/C20H16N8O/c1-11(17-12(2)28(27-24-17)20-19(21)25-29-26-20)22-23-18-15-9-5-3-7-13(15)14-8-4-6-10-16(14)18/h3-10H,1-2H3,(H2,21,25)

InChI Key

SSTIRTZSGPHNCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00759642

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.626

Distribution Coefficient, logD

3.626

Water Solubility, LogSw

-3.93

Polar Surface Area

100.633

Acid Dissociation Constant (pKa)

15.15

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with 8006-9668 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-9668?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-9668
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-9668
  • 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 8006-9668 available by request