8008-3468 Screening compound: 5-[(2E)-2-[(3,4-dimethoxyphenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-1,2-thiazole-4-carbonitrile

8008-3468 Screening compound: 5-[(2E)-2-[(3,4-dimethoxyphenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-1,2-thiazole-4-carbonitrile
8008-3468 Screening compound: 5-[(2E)-2-[(3,4-dimethoxyphenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-1,2-thiazole-4-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-3468
5-[(2E)-2-[(3,4-dimethoxyphenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-1,2-thiazole-4-carbonitrile

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

8008-3468

Molecular Formula

C14H14N4O2S2 (C14 H14 N4 O2 S2)

Compound Name

5-[(2E)-2-[(3,4-dimethoxyphenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-1,2-thiazole-4-carbonitrile

IUPAC name

5-[(2E)-2-[(34-dimethoxyphenyl)methylidene]hydrazin-1-yl]-3-(methylsulfanyl)-12-thiazole-4-carbonitrile

SMILES

COc(ccc(/C=N/Nc(snc1SC)c1C#N)c1)c1OC

InChI

InChI=1S/C14H14N4O2S2/c1-19-11-5-4-9(6-12(11)20-2)8-16-17-13-10(7-15)14(21-3)18-22-13/h4-6,8,17H,1-3H3

InChI Key

ZBKLKXXWAJJABZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01306021

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.147

Distribution Coefficient, logD

3.147

Water Solubility, LogSw

-3.35

Polar Surface Area

63.091

Acid Dissociation Constant (pKa)

11.78

Base Dissociation Constant (pKb)

2.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

8008-3468 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS Annotated Library (688 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 8008-3468 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-3468?
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What is the minimum amount of 8008-3468 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-3468
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-3468
  • 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 8008-3468 available by request