8005-6169 Screening compound: N'-[(E)-(naphthalen-1-yl)methylidene]-1,5-diphenyl-1H-1,2,4-triazole-3-carbohydrazide

8005-6169 Screening compound: N'-[(E)-(naphthalen-1-yl)methylidene]-1,5-diphenyl-1H-1,2,4-triazole-3-carbohydrazide
8005-6169 Screening compound: N'-[(E)-(naphthalen-1-yl)methylidene]-1,5-diphenyl-1H-1,2,4-triazole-3-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-6169
N'-[(E)-(naphthalen-1-yl)methylidene]-1,5-diphenyl-1H-1,2,4-triazole-3-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

8005-6169

Molecular Formula

C26H19N5O (C26 H19 N5 O)

Compound Name

N'-[(E)-(naphthalen-1-yl)methylidene]-1,5-diphenyl-1H-1,2,4-triazole-3-carbohydrazide

IUPAC name

N'-[(E)-(naphthalen-1-yl)methylidene]-15-diphenyl-1H-124-triazole-3-carbohydrazide

SMILES

O=C(c(nc1-c2ccccc2)nn1-c1ccccc1)N/N=C/c1cccc2ccccc12

InChI

InChI=1S/C26H19N5O/c32-26(29-27-18-21-14-9-13-19-10-7-8-17-23(19)21)24-28-25(20-11-3-1-4-12-20)31(30-24)22-15-5-2-6-16-22/h1-18H,(H,29,32)

InChI Key

QSYQRLZCPKMKJV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00820896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.945

Distribution Coefficient, logD

5.945

Water Solubility, LogSw

-7.15

Polar Surface Area

58.933

Acid Dissociation Constant (pKa)

10.81

Base Dissociation Constant (pKb)

-0.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8005-6169 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8005-6169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-6169?
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What is the minimum amount of 8005-6169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-6169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-6169
  • 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 8005-6169 available by request