6011-0764 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dipropylamino)methyl]-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide

6011-0764 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dipropylamino)methyl]-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
6011-0764 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dipropylamino)methyl]-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6011-0764
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dipropylamino)methyl]-N'-[(E)-(2,3,4-trimethoxyphenyl)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

6011-0764

Molecular Formula

C22H31N9O5 (C22 H31 N9 O5)

Compound Name

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

IUPAC name

1-(4-amino-125-oxadiazol-3-yl)-5-[(dipropylamino)methyl]-N'-[(E)-(234-trimethoxyphenyl)methylidene]-1H-123-triazole-4-carbohydrazide

SMILES

CCCN(CCC)Cc1c(C(N/N=C/c(ccc(OC)c2OC)c2OC)=O)nnn1-c1nonc1N

InChI

InChI=1S/C22H31N9O5/c1-6-10-30(11-7-2)13-15-17(25-29-31(15)21-20(23)27-36-28-21)22(32)26-24-12-14-8-9-16(33-3)19(35-5)18(14)34-4/h8-9,12H,6-7,10-11,13H2,1-5H3,(H2,23,27)(H,26,32)

InChI Key

SBQUPYRLOJVGQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14711110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

501.55

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

14

Partition Coefficient, logP

2.669

Distribution Coefficient, logD

1.955

Water Solubility, LogSw

-2.91

Polar Surface Area

145.160

Acid Dissociation Constant (pKa)

9.58

Base Dissociation Constant (pKb)

8.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

6011-0764 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 6011-0764 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6011-0764?
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What is the minimum amount of 6011-0764 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6011-0764
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6011-0764
  • 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 6011-0764 available by request