3324-0115 Screening compound: 4-fluoro-N'-{4-[(5E)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]butanoyl}benzohydrazide

3324-0115 Screening compound: 4-fluoro-N'-{4-[(5E)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]butanoyl}benzohydrazide
3324-0115 Screening compound: 4-fluoro-N'-{4-[(5E)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]butanoyl}benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3324-0115
4-fluoro-N'-{4-[(5E)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]butanoyl}benzohydrazide

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

3324-0115

Molecular Formula

C19H16FN3O3S3 (C19 H16 FN3 O3 S3)

Compound Name

4-fluoro-N'-{4-[(5E)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]butanoyl}benzohydrazide

IUPAC name

4-fluoro-N'-{4-[(5E)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-13-thiazolidin-3-yl]butanoyl}benzohydrazide

SMILES

O=C(CCCN(C(/C(/S1)=C\c2cccs2)=O)C1=S)NNC(c(cc1)ccc1F)=O

InChI

InChI=1S/C19H16FN3O3S3/c20-13-7-5-12(6-8-13)17(25)22-21-16(24)4-1-9-23-18(26)15(29-19(23)27)11-14-3-2-10-28-14/h2-3,5-8,10-11H,1,4,9H2,(H,21,24)(H,22,25)

InChI Key

OZAVCXOVSDDZRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02165559

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.348

Distribution Coefficient, logD

2.328

Water Solubility, LogSw

-2.65

Polar Surface Area

68.694

Acid Dissociation Constant (pKa)

8.73

Base Dissociation Constant (pKb)

-1.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

3324-0115 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Therapeutical Diversity Annotated Library (7563 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 3324-0115 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3324-0115?
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What is the minimum amount of 3324-0115 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3324-0115
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3324-0115
  • 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 3324-0115 available by request