3448-7542 Screening compound: 5-{[(2,4-dichlorophenyl)methyl]sulfanyl}-1-(4-fluorophenyl)-1H-1,2,3,4-tetrazole

3448-7542 Screening compound: 5-{[(2,4-dichlorophenyl)methyl]sulfanyl}-1-(4-fluorophenyl)-1H-1,2,3,4-tetrazole
3448-7542 Screening compound: 5-{[(2,4-dichlorophenyl)methyl]sulfanyl}-1-(4-fluorophenyl)-1H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 3448-7542
5-{[(2,4-dichlorophenyl)methyl]sulfanyl}-1-(4-fluorophenyl)-1H-1,2,3,4-tetrazole

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

3448-7542

Molecular Formula

C14H9Cl2FN4S (C14 H9 Cl2 FN4 S)

Compound Name

5-{[(2,4-dichlorophenyl)methyl]sulfanyl}-1-(4-fluorophenyl)-1H-1,2,3,4-tetrazole

IUPAC name

5-{[(24-dichlorophenyl)methyl]sulfanyl}-1-(4-fluorophenyl)-1H-1234-tetrazole

SMILES

Fc(cc1)ccc1-n1nnnc1SCc(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C14H9Cl2FN4S/c15-10-2-1-9(13(16)7-10)8-22-14-18-19-20-21(14)12-5-3-11(17)4-6-12/h1-7H,8H2

InChI Key

MWVMEUGQTJQXAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02070663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.22

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.935

Distribution Coefficient, logD

4.935

Water Solubility, LogSw

-5.12

Polar Surface Area

39.889

Acid Dissociation Constant (pKa)

23.94

Base Dissociation Constant (pKb)

-2.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

3448-7542 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3448-7542 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3448-7542?
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What is the minimum amount of 3448-7542 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3448-7542
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3448-7542
  • 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 3448-7542 available by request