2332-0621 Screening compound: N'-[(E)-(3,4-dihydroxyphenyl)methylidene]-2-[(1-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]acetohydrazide

2332-0621 Screening compound: N'-[(E)-(3,4-dihydroxyphenyl)methylidene]-2-[(1-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]acetohydrazide
2332-0621 Screening compound: N'-[(E)-(3,4-dihydroxyphenyl)methylidene]-2-[(1-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2332-0621
N'-[(E)-(3,4-dihydroxyphenyl)methylidene]-2-[(1-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]acetohydrazide

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

2332-0621

Molecular Formula

C17H16N4O3S (C17 H16 N4 O3 S)

Compound Name

N'-[(E)-(3,4-dihydroxyphenyl)methylidene]-2-[(1-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]acetohydrazide

IUPAC name

N'-[(E)-(34-dihydroxyphenyl)methylidene]-2-[(1-methyl-1H-13-benzodiazol-2-yl)sulfanyl]acetohydrazide

SMILES

Cn1c(SCC(N/N=C/c(cc2)cc(O)c2O)=O)nc2c1cccc2

InChI

InChI=1S/C17H16N4O3S/c1-21-13-5-3-2-4-12(13)19-17(21)25-10-16(24)20-18-9-11-6-7-14(22)15(23)8-11/h2-9,22-23H,10H2,1H3,(H,20,24)

InChI Key

YTUONBJKSAPACR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01230908

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.272

Distribution Coefficient, logD

2.265

Water Solubility, LogSw

-2.56

Polar Surface Area

80.029

Acid Dissociation Constant (pKa)

9.54

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

2332-0621 in Drug Discovery

Included in Screening Libraries

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 2332-0621 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 2332-0621 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2332-0621
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2332-0621
  • 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 2332-0621 available by request