8018-8791 Screening compound: 2-(4-fluorophenyl)-1-[2-(2-methoxyphenoxy)ethyl]-1H-1,3-benzodiazole

8018-8791 Screening compound: 2-(4-fluorophenyl)-1-[2-(2-methoxyphenoxy)ethyl]-1H-1,3-benzodiazole
8018-8791 Screening compound: 2-(4-fluorophenyl)-1-[2-(2-methoxyphenoxy)ethyl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8791
2-(4-fluorophenyl)-1-[2-(2-methoxyphenoxy)ethyl]-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

8018-8791

Molecular Formula

C22H19FN2O2 (C22 H19 FN2 O2)

Compound Name

2-(4-fluorophenyl)-1-[2-(2-methoxyphenoxy)ethyl]-1H-1,3-benzodiazole

IUPAC name

2-(4-fluorophenyl)-1-[2-(2-methoxyphenoxy)ethyl]-1H-13-benzodiazole

SMILES

COc(cccc1)c1OCCn1c(-c(cc2)ccc2F)nc2c1cccc2

InChI

InChI=1S/C22H19FN2O2/c1-26-20-8-4-5-9-21(20)27-15-14-25-19-7-3-2-6-18(19)24-22(25)16-10-12-17(23)13-11-16/h2-13H,14-15H2,1H3

InChI Key

XOWUKQMBEAKVBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08834300

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.4

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.397

Distribution Coefficient, logD

5.397

Water Solubility, LogSw

-5.64

Polar Surface Area

25.009

Acid Dissociation Constant (pKa)

22.66

Base Dissociation Constant (pKb)

3.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

8018-8791 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 8018-8791 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8791?
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What is the minimum amount of 8018-8791 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8791
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8791
  • 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 8018-8791 available by request