C797-0147 Screening compound: 4-[(1E)-1-(hydroxyimino)ethyl]benzene-1,3-diol

C797-0147 Screening compound: 4-[(1E)-1-(hydroxyimino)ethyl]benzene-1,3-diol
C797-0147 Screening compound: 4-[(1E)-1-(hydroxyimino)ethyl]benzene-1,3-diol alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-0147
4-[(1E)-1-(hydroxyimino)ethyl]benzene-1,3-diol

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

C797-0147

Molecular Formula

C8H9NO3 (C8 H9 NO3)

Compound Name

4-[(1E)-1-(hydroxyimino)ethyl]benzene-1,3-diol

IUPAC name

4-[(1E)-1-(hydroxyimino)ethyl]benzene-13-diol

SMILES

C/C(/c(ccc(O)c1)c1O)=N\O

InChI

InChI=1S/C8H9NO3/c1-5(9-12)7-3-2-6(10)4-8(7)11/h2-4,10-12H,1H3

InChI Key

FQPRUMXSHZSJGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00043493

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

167.16

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.281

Distribution Coefficient, logD

1.277

Water Solubility, LogSw

-1.54

Polar Surface Area

63.596

Acid Dissociation Constant (pKa)

9.46

Base Dissociation Constant (pKb)

0.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

C797-0147 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Cardiovascular Library (22201 compounds)

PLpro Library (6343 compounds)

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C797-0147 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C797-0147?
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What is the minimum amount of C797-0147 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-0147
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-0147
  • 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 C797-0147 available by request