8001-7216 Screening compound: 2-[(E)-[(4-bromophenyl)imino]methyl]-4,6-dichlorophenol

8001-7216 Screening compound: 2-[(E)-[(4-bromophenyl)imino]methyl]-4,6-dichlorophenol
8001-7216 Screening compound: 2-[(E)-[(4-bromophenyl)imino]methyl]-4,6-dichlorophenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8001-7216
2-[(E)-[(4-bromophenyl)imino]methyl]-4,6-dichlorophenol

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

8001-7216

Molecular Formula

C13H8BrCl2NO (C13 H8 BrCl2 NO)

Compound Name

2-[(E)-[(4-bromophenyl)imino]methyl]-4,6-dichlorophenol

IUPAC name

2-[(E)-[(4-bromophenyl)imino]methyl]-46-dichlorophenol

SMILES

Oc(c(Cl)c1)c(/C=N/c(cc2)ccc2Br)cc1Cl

InChI

InChI=1S/C13H8BrCl2NO/c14-9-1-3-11(4-2-9)17-7-8-5-10(15)6-12(16)13(8)18/h1-7,18H

InChI Key

SCFYGKJRFQUEST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00557156

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.02

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.382

Distribution Coefficient, logD

4.802

Water Solubility, LogSw

-5.65

Polar Surface Area

23.845

Acid Dissociation Constant (pKa)

6.95

Base Dissociation Constant (pKb)

3.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8001-7216 in Drug Discovery

Included in Screening Libraries

Human GPCR Annotated Library (5539 compounds)

Selective Target Activity Profiling Library (14702 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 8001-7216 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8001-7216?
Check Price and Availability of 8001-7216, 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 8001-7216 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8001-7216
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8001-7216
  • 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 8001-7216 available by request