0508-1972 Screening compound: 2-[(E)-[(2-benzoyl-4-bromophenyl)imino]methyl]phenol

0508-1972 Screening compound: 2-[(E)-[(2-benzoyl-4-bromophenyl)imino]methyl]phenol
0508-1972 Screening compound: 2-[(E)-[(2-benzoyl-4-bromophenyl)imino]methyl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0508-1972
2-[(E)-[(2-benzoyl-4-bromophenyl)imino]methyl]phenol

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

0508-1972

Molecular Formula

C20H14BrNO2 (C20 H14 BrNO2)

Compound Name

2-[(E)-[(2-benzoyl-4-bromophenyl)imino]methyl]phenol

IUPAC name

2-[(E)-[(2-benzoyl-4-bromophenyl)imino]methyl]phenol

SMILES

Oc1c(/C=N/c(ccc(Br)c2)c2C(c2ccccc2)=O)cccc1

InChI

InChI=1S/C20H14BrNO2/c21-16-10-11-18(22-13-15-8-4-5-9-19(15)23)17(12-16)20(24)14-6-2-1-3-7-14/h1-13,23H

InChI Key

LNZUWJPUMJSHIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00524985

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.24

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.096

Distribution Coefficient, logD

5.063

Water Solubility, LogSw

-4.81

Polar Surface Area

37.683

Acid Dissociation Constant (pKa)

8.51

Base Dissociation Constant (pKb)

0.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0508-1972 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 0508-1972 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0508-1972?
Check Price and Availability of 0508-1972, 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 0508-1972 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0508-1972
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0508-1972
  • 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 0508-1972 available by request