6190-0446 Screening compound: (Z)-4-amino-N'-[(E)-[(2-hydroxy-3-methoxyphenyl)methylidene]amino]-1,2,5-oxadiazole-3-carboximidamide

6190-0446 Screening compound: (Z)-4-amino-N'-[(E)-[(2-hydroxy-3-methoxyphenyl)methylidene]amino]-1,2,5-oxadiazole-3-carboximidamide
6190-0446 Screening compound: (Z)-4-amino-N'-[(E)-[(2-hydroxy-3-methoxyphenyl)methylidene]amino]-1,2,5-oxadiazole-3-carboximidamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6190-0446
(Z)-4-amino-N'-[(E)-[(2-hydroxy-3-methoxyphenyl)methylidene]amino]-1,2,5-oxadiazole-3-carboximidamide

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

6190-0446

Molecular Formula

C11H12N6O3 (C11 H12 N6 O3)

Compound Name

(Z)-4-amino-N'-[(E)-[(2-hydroxy-3-methoxyphenyl)methylidene]amino]-1,2,5-oxadiazole-3-carboximidamide

IUPAC name

(Z)-4-amino-N'-[(E)-[(2-hydroxy-3-methoxyphenyl)methylidene]amino]-125-oxadiazole-3-carboximidamide

SMILES

COc1cccc(/C=N/N=C(/c2nonc2N)\N)c1O

InChI

InChI=1S/C11H12N6O3/c1-19-7-4-2-3-6(9(7)18)5-14-15-10(12)8-11(13)17-20-16-8/h2-5,18H,1H3,(H2,12,15)(H2,13,17)

InChI Key

HWKFTMMZUDOVEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01044713

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.25

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

5.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.160

Distribution Coefficient, logD

1.152

Water Solubility, LogSw

-1.94

Polar Surface Area

119.718

Acid Dissociation Constant (pKa)

9.28

Base Dissociation Constant (pKb)

5.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

6190-0446 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human GPCR Annotated Library (5539 compounds)

Human Receptors Annotated Library (5376 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 6190-0446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6190-0446?
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What is the minimum amount of 6190-0446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6190-0446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6190-0446
  • 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 6190-0446 available by request