8019-3294 Screening compound: 2-(3-bromophenyl)-1-[3-(4-chlorophenoxy)propyl]-1H-1,3-benzodiazole

8019-3294 Screening compound: 2-(3-bromophenyl)-1-[3-(4-chlorophenoxy)propyl]-1H-1,3-benzodiazole
8019-3294 Screening compound: 2-(3-bromophenyl)-1-[3-(4-chlorophenoxy)propyl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-3294
2-(3-bromophenyl)-1-[3-(4-chlorophenoxy)propyl]-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

8019-3294

Molecular Formula

C22H18BrClN2O (C22 H18 BrClN2 O)

Compound Name

2-(3-bromophenyl)-1-[3-(4-chlorophenoxy)propyl]-1H-1,3-benzodiazole

IUPAC name

2-(3-bromophenyl)-1-[3-(4-chlorophenoxy)propyl]-1H-13-benzodiazole

SMILES

Clc(cc1)ccc1OCCCn1c(-c2cccc(Br)c2)nc2c1cccc2

InChI

InChI=1S/C22H18BrClN2O/c23-17-6-3-5-16(15-17)22-25-20-7-1-2-8-21(20)26(22)13-4-14-27-19-11-9-18(24)10-12-19/h1-3,5-12,15H,4,13-14H2

InChI Key

QPMKNZOMRIJOIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04488720

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.75

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

7.349

Distribution Coefficient, logD

7.349

Water Solubility, LogSw

-6.82

Polar Surface Area

17.292

Acid Dissociation Constant (pKa)

22.30

Base Dissociation Constant (pKb)

4.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

8019-3294 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8019-3294 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-3294?
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What is the minimum amount of 8019-3294 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-3294
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-3294
  • 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 8019-3294 available by request