6011-0771 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dipropylamino)methyl]-N'-[(E)-(furan-3-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide

6011-0771 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dipropylamino)methyl]-N'-[(E)-(furan-3-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
6011-0771 Screening compound: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dipropylamino)methyl]-N'-[(E)-(furan-3-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6011-0771
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dipropylamino)methyl]-N'-[(E)-(furan-3-yl)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

6011-0771

Molecular Formula

C17H23N9O3 (C17 H23 N9 O3)

Compound Name

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

IUPAC name

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

SMILES

CCCN(CCC)Cc1c(C(N/N=C/c2cocc2)=O)nnn1-c1nonc1N

InChI

InChI=1S/C17H23N9O3/c1-3-6-25(7-4-2)10-13-14(17(27)21-19-9-12-5-8-28-11-12)20-24-26(13)16-15(18)22-29-23-16/h5,8-9,11H,3-4,6-7,10H2,1-2H3,(H2,18,22)(H,21,27)

InChI Key

GRUQXVFDQCBPEG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14711116

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.43

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

1.937

Distribution Coefficient, logD

1.223

Water Solubility, LogSw

-2.50

Polar Surface Area

129.898

Acid Dissociation Constant (pKa)

8.82

Base Dissociation Constant (pKb)

8.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

6011-0771 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6011-0771 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6011-0771?
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What is the minimum amount of 6011-0771 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6011-0771
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6011-0771
  • 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 6011-0771 available by request