3324-0120 Screening compound: N'-{4-[(5E)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]butanoyl}pyridine-4-carbohydrazide

3324-0120 Screening compound: N'-{4-[(5E)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]butanoyl}pyridine-4-carbohydrazide
3324-0120 Screening compound: N'-{4-[(5E)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]butanoyl}pyridine-4-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3324-0120
N'-{4-[(5E)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]butanoyl}pyridine-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

3324-0120

Molecular Formula

C18H16N4O3S3 (C18 H16 N4 O3 S3)

Compound Name

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

IUPAC name

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

SMILES

O=C(CCCN(C(/C(/S1)=C\c2cccs2)=O)C1=S)NNC(c1ccncc1)=O

InChI

InChI=1S/C18H16N4O3S3/c23-15(20-21-16(24)12-5-7-19-8-6-12)4-1-9-22-17(25)14(28-18(22)26)11-13-3-2-10-27-13/h2-3,5-8,10-11H,1,4,9H2,(H,20,23)(H,21,24)

InChI Key

MWIWYPYHDXADGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02165558

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.070

Distribution Coefficient, logD

1.058

Water Solubility, LogSw

-1.79

Polar Surface Area

78.122

Acid Dissociation Constant (pKa)

8.95

Base Dissociation Constant (pKb)

3.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

3324-0120 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 3324-0120 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3324-0120?
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What is the minimum amount of 3324-0120 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3324-0120
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3324-0120
  • 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 3324-0120 available by request