8008-4673 Screening compound: 1-[(2,4-dichlorophenyl)methyl]-2-(ethylsulfanyl)-1H-1,3-benzodiazole

8008-4673 Screening compound: 1-[(2,4-dichlorophenyl)methyl]-2-(ethylsulfanyl)-1H-1,3-benzodiazole
8008-4673 Screening compound: 1-[(2,4-dichlorophenyl)methyl]-2-(ethylsulfanyl)-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-4673
1-[(2,4-dichlorophenyl)methyl]-2-(ethylsulfanyl)-1H-1,3-benzodiazole

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

8008-4673

Molecular Formula

C16H14Cl2N2S (C16 H14 Cl2 N2 S)

Compound Name

1-[(2,4-dichlorophenyl)methyl]-2-(ethylsulfanyl)-1H-1,3-benzodiazole

IUPAC name

1-[(24-dichlorophenyl)methyl]-2-(ethylsulfanyl)-1H-13-benzodiazole

SMILES

CCSc1nc(cccc2)c2n1Cc(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C16H14Cl2N2S/c1-2-21-16-19-14-5-3-4-6-15(14)20(16)10-11-7-8-12(17)9-13(11)18/h3-9H,2,10H2,1H3

InChI Key

TZJLFKCSGFKTKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01207131

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.27

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

6.085

Distribution Coefficient, logD

6.075

Water Solubility, LogSw

-6.22

Polar Surface Area

10.749

Acid Dissociation Constant (pKa)

22.50

Base Dissociation Constant (pKb)

5.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

8008-4673 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8008-4673 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-4673?
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What is the minimum amount of 8008-4673 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-4673
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-4673
  • 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 8008-4673 available by request