8005-2821 Screening compound: N'~1~-{(E)-1-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]ethylidene}-4-methylbenzohydrazide

8005-2821 Screening compound: N'~1~-{(E)-1-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]ethylidene}-4-methylbenzohydrazide
8005-2821 Screening compound: N'~1~-{(E)-1-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]ethylidene}-4-methylbenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-2821
N'~1~-{(E)-1-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]ethylidene}-4-methylbenzohydrazide

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

8005-2821

Molecular Formula

C15H16N8O2 (C15 H16 N8 O2)

Compound Name

N'~1~-{(E)-1-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]ethylidene}-4-methylbenzohydrazide

IUPAC name

N'-[(1E)-1-[1-(4-amino-125-oxadiazol-3-yl)-5-methyl-1H-123-triazol-4-yl]ethylidene]-4-methylbenzohydrazide

SMILES

C/C(/c1c(C)n(-c2nonc2N)nn1)=N\NC(c1ccc(C)cc1)=O

InChI

InChI=1S/C15H16N8O2/c1-8-4-6-11(7-5-8)15(24)19-17-9(2)12-10(3)23(22-18-12)14-13(16)20-25-21-14/h4-7H,1-3H3,(H2,16,20)(H,19,24)

InChI Key

OWBFLVYLLQPBBE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00748028

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.34

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.847

Distribution Coefficient, logD

1.685

Water Solubility, LogSw

-2.21

Polar Surface Area

117.933

Acid Dissociation Constant (pKa)

7.74

Base Dissociation Constant (pKb)

1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 8005-2821 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-2821?
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What is the minimum amount of 8005-2821 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-2821
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-2821
  • 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 8005-2821 available by request