8007-7423 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(azepan-1-yl)methyl]-N'-[(E)-[4-(pentyloxy)phenyl]methylidene]-1H-1,2,3-triazole-4-carbohydrazide

8007-7423 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(azepan-1-yl)methyl]-N'-[(E)-[4-(pentyloxy)phenyl]methylidene]-1H-1,2,3-triazole-4-carbohydrazide
8007-7423 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(azepan-1-yl)methyl]-N'-[(E)-[4-(pentyloxy)phenyl]methylidene]-1H-1,2,3-triazole-4-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-7423
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(azepan-1-yl)methyl]-N'-[(E)-[4-(pentyloxy)phenyl]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

8007-7423

Molecular Formula

C24H33N9O3 (C24 H33 N9 O3)

Compound Name

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

IUPAC name

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

SMILES

CCCCCOc1ccc(/C=N/NC(c2c(CN3CCCCCC3)n(-c3nonc3N)nn2)=O)cc1

InChI

InChI=1S/C24H33N9O3/c1-2-3-8-15-35-19-11-9-18(10-12-19)16-26-28-24(34)21-20(17-32-13-6-4-5-7-14-32)33(31-27-21)23-22(25)29-36-30-23/h9-12,16H,2-8,13-15,17H2,1H3,(H2,25,29)(H,28,34)

InChI Key

UATPLBTXNAFDAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01240701

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.58

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

4.157

Distribution Coefficient, logD

3.587

Water Solubility, LogSw

-4.02

Polar Surface Area

129.636

Acid Dissociation Constant (pKa)

8.66

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

8007-7423 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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 8007-7423 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-7423?
Check Price and Availability of 8007-7423, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8007-7423 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-7423
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-7423
  • 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 8007-7423 available by request