8013-3383 Screening compound: 2-[(4-chlorophenoxy)methyl]-1-(2-phenylethyl)-1H-1,3-benzodiazole

8013-3383 Screening compound: 2-[(4-chlorophenoxy)methyl]-1-(2-phenylethyl)-1H-1,3-benzodiazole
8013-3383 Screening compound: 2-[(4-chlorophenoxy)methyl]-1-(2-phenylethyl)-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-3383
2-[(4-chlorophenoxy)methyl]-1-(2-phenylethyl)-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

8013-3383

Molecular Formula

C22H19ClN2O (C22 H19 ClN2 O)

Compound Name

2-[(4-chlorophenoxy)methyl]-1-(2-phenylethyl)-1H-1,3-benzodiazole

IUPAC name

2-[(4-chlorophenoxy)methyl]-1-(2-phenylethyl)-1H-13-benzodiazole

SMILES

Clc(cc1)ccc1OCc1nc(cccc2)c2n1CCc1ccccc1

InChI

InChI=1S/C22H19ClN2O/c23-18-10-12-19(13-11-18)26-16-22-24-20-8-4-5-9-21(20)25(22)15-14-17-6-2-1-3-7-17/h1-13H,14-16H2

InChI Key

HEIGOAMDDXABRI-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.86

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.706

Distribution Coefficient, logD

5.706

Water Solubility, LogSw

-6.07

Polar Surface Area

18.349

Acid Dissociation Constant (pKa)

23.27

Base Dissociation Constant (pKb)

2.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.64

References: we are preparing a list of scientific research reports with 8013-3383 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-3383?
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What is the minimum amount of 8013-3383 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-3383
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-3383
  • 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 8013-3383 available by request