8009-0325 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(1-methyl-4-nitro-1H-pyrazole-3-carbonyl)-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide

8009-0325 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(1-methyl-4-nitro-1H-pyrazole-3-carbonyl)-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
8009-0325 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(1-methyl-4-nitro-1H-pyrazole-3-carbonyl)-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-0325
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(1-methyl-4-nitro-1H-pyrazole-3-carbonyl)-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide

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

8009-0325

Molecular Formula

C16H13N11O5 (C16 H13 N11 O5)

Compound Name

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(1-methyl-4-nitro-1H-pyrazole-3-carbonyl)-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide

IUPAC name

1-(4-amino-125-oxadiazol-3-yl)-N'-(1-methyl-4-nitro-1H-pyrazole-3-carbonyl)-5-phenyl-1H-123-triazole-4-carbohydrazide

SMILES

Cn1nc(C(NNC(c2c(-c3ccccc3)n(-c3nonc3N)nn2)=O)=O)c([N+]([O-])=O)c1

InChI

InChI=1S/C16H13N11O5/c1-25-7-9(27(30)31)10(21-25)15(28)19-20-16(29)11-12(8-5-3-2-4-6-8)26(24-18-11)14-13(17)22-32-23-14/h2-7H,1H3,(H2,17,22)(H,19,28)(H,20,29)

InChI Key

WKGNBLMGUFMDEO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01460836

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.35

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

16

Partition Coefficient, logP

-0.140

Distribution Coefficient, logD

-0.272

Water Solubility, LogSw

-1.72

Polar Surface Area

181.719

Acid Dissociation Constant (pKa)

7.85

Base Dissociation Constant (pKb)

-2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

References: we are preparing a list of scientific research reports with 8009-0325 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-0325?
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What is the minimum amount of 8009-0325 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-0325
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-0325
  • 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 8009-0325 available by request