8015-3452 Screening compound: 5-{4-[(2-fluorophenyl)methoxy]phenyl}-2-[(2-fluorophenyl)methyl]-2H-1,2,3,4-tetrazole

8015-3452 Screening compound: 5-{4-[(2-fluorophenyl)methoxy]phenyl}-2-[(2-fluorophenyl)methyl]-2H-1,2,3,4-tetrazole
8015-3452 Screening compound: 5-{4-[(2-fluorophenyl)methoxy]phenyl}-2-[(2-fluorophenyl)methyl]-2H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-3452
5-{4-[(2-fluorophenyl)methoxy]phenyl}-2-[(2-fluorophenyl)methyl]-2H-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

8015-3452

Molecular Formula

C21H16F2N4O (C21 H16 F2 N4 O)

Compound Name

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

IUPAC name

5-{4-[(2-fluorophenyl)methoxy]phenyl}-2-[(2-fluorophenyl)methyl]-2H-1234-tetrazole

SMILES

Fc1c(Cn2nnc(-c(cc3)ccc3OCc(cccc3)c3F)n2)cccc1

InChI

InChI=1S/C21H16F2N4O/c22-19-7-3-1-5-16(19)13-27-25-21(24-26-27)15-9-11-18(12-10-15)28-14-17-6-2-4-8-20(17)23/h1-12H,13-14H2

InChI Key

BKUQPNPDEHRGAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04060836

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.979

Distribution Coefficient, logD

4.979

Water Solubility, LogSw

-4.97

Polar Surface Area

45.569

Acid Dissociation Constant (pKa)

27.36

Base Dissociation Constant (pKb)

-4.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

8015-3452 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Anti-Inflammatory Library (24602 compounds)

CNS targets activity set (6557 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8015-3452 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-3452?
Check Price and Availability of 8015-3452, 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 8015-3452 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-3452
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-3452
  • 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 8015-3452 available by request