8003-6674 Screening compound: 4-fluorobenzyl (1-methyl-1H-1,2,3,4-tetraazol-5-yl) sulfide

8003-6674 Screening compound: 4-fluorobenzyl (1-methyl-1H-1,2,3,4-tetraazol-5-yl) sulfide
8003-6674 Screening compound: 4-fluorobenzyl (1-methyl-1H-1,2,3,4-tetraazol-5-yl) sulfide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-6674
4-fluorobenzyl (1-methyl-1H-1,2,3,4-tetraazol-5-yl) sulfide

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

8003-6674

Molecular Formula

C9H9FN4S (C9 H9 FN4 S)

Compound Name

4-fluorobenzyl (1-methyl-1H-1,2,3,4-tetraazol-5-yl) sulfide

IUPAC name

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

SMILES

Cn1nnnc1SCc(cc1)ccc1F

InChI

InChI=1S/C9H9FN4S/c1-14-9(11-12-13-14)15-6-7-2-4-8(10)5-3-7/h2-5H,6H2,1H3

InChI Key

SRWMTIZQTFJYKP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00735847

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

224.26

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.508

Distribution Coefficient, logD

1.508

Water Solubility, LogSw

-1.64

Polar Surface Area

40.310

Acid Dissociation Constant (pKa)

23.82

Base Dissociation Constant (pKb)

-1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.22

8003-6674 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 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 8003-6674 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-6674?
Check Price and Availability of 8003-6674, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8003-6674 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-6674
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-6674
  • 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 8003-6674 available by request