1307-0025 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-[(E)-(3-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide

1307-0025 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-[(E)-(3-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
1307-0025 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-[(E)-(3-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1307-0025
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-[(E)-(3-nitrophenyl)methylidene]-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

1307-0025

Molecular Formula

C13H11N9O4 (C13 H11 N9 O4)

Compound Name

1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-[(E)-(3-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide

IUPAC name

1-(4-amino-125-oxadiazol-3-yl)-5-methyl-N'-[(E)-(3-nitrophenyl)methylidene]-1H-123-triazole-4-carbohydrazide

SMILES

Cc1c(C(N/N=C/c2cccc([N+]([O-])=O)c2)=O)nnn1-c1nonc1N

InChI

InChI=1S/C13H11N9O4/c1-7-10(16-20-21(7)12-11(14)18-26-19-12)13(23)17-15-6-8-3-2-4-9(5-8)22(24)25/h2-6H,1H3,(H2,14,18)(H,17,23)

InChI Key

SANPLBLDIDELQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00770684

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.29

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

13

Partition Coefficient, logP

1.183

Distribution Coefficient, logD

1.168

Water Solubility, LogSw

-2.28

Polar Surface Area

152.026

Acid Dissociation Constant (pKa)

8.85

Base Dissociation Constant (pKb)

-0.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

References: we are preparing a list of scientific research reports with 1307-0025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1307-0025?
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What is the minimum amount of 1307-0025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1307-0025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1307-0025
  • 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 1307-0025 available by request