4340-2103 Screening compound: 1-(4-fluorobenzoyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-1H-1,3-benzodiazole

4340-2103 Screening compound: 1-(4-fluorobenzoyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-1H-1,3-benzodiazole
4340-2103 Screening compound: 1-(4-fluorobenzoyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4340-2103
1-(4-fluorobenzoyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-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

4340-2103

Molecular Formula

C21H14F2N2OS (C21 H14 F2 N2 OS)

Compound Name

1-(4-fluorobenzoyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-1H-1,3-benzodiazole

IUPAC name

1-(4-fluorobenzoyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-1H-13-benzodiazole

SMILES

O=C(c(cc1)ccc1F)n1c(SCc(cc2)ccc2F)nc2c1cccc2

InChI

InChI=1S/C21H14F2N2OS/c22-16-9-5-14(6-10-16)13-27-21-24-18-3-1-2-4-19(18)25(21)20(26)15-7-11-17(23)12-8-15/h1-12H,13H2

InChI Key

RNGZGNBFQXDJCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02989209

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.702

Distribution Coefficient, logD

4.702

Water Solubility, LogSw

-4.84

Polar Surface Area

24.417

Acid Dissociation Constant (pKa)

24.17

Base Dissociation Constant (pKb)

2.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

4340-2103 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with 4340-2103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4340-2103?
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What is the minimum amount of 4340-2103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4340-2103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4340-2103
  • 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 4340-2103 available by request