C151-0236 Screening compound: (2E)-2-[(5-bromo-2-methoxyphenyl)methylidene]-2,3-dihydro-1H-inden-1-one

C151-0236 Screening compound: (2E)-2-[(5-bromo-2-methoxyphenyl)methylidene]-2,3-dihydro-1H-inden-1-one
C151-0236 Screening compound: (2E)-2-[(5-bromo-2-methoxyphenyl)methylidene]-2,3-dihydro-1H-inden-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C151-0236
(2E)-2-[(5-bromo-2-methoxyphenyl)methylidene]-2,3-dihydro-1H-inden-1-one

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

C151-0236

Molecular Formula

C17H13BrO2 (C17 H13 BrO2)

Compound Name

(2E)-2-[(5-bromo-2-methoxyphenyl)methylidene]-2,3-dihydro-1H-inden-1-one

IUPAC name

(2E)-2-[(5-bromo-2-methoxyphenyl)methylidene]-23-dihydro-1H-inden-1-one

SMILES

COc(cc1)c(/C=C(\Cc2c3cccc2)/C3=O)cc1Br

InChI

InChI=1S/C17H13BrO2/c1-20-16-7-6-14(18)10-12(16)9-13-8-11-4-2-3-5-15(11)17(13)19/h2-7,9-10H,8H2,1H3

InChI Key

UHWAEMPLKXEYFL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03828973

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.19

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.886

Distribution Coefficient, logD

4.886

Water Solubility, LogSw

-4.81

Polar Surface Area

21.030

Acid Dissociation Constant (pKa)

16.96

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

C151-0236 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C151-0236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C151-0236?
Check Price and Availability of C151-0236, 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 C151-0236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C151-0236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C151-0236
  • 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 C151-0236 available by request