0350-0068 Screening compound: (2E)-3-(1H-indol-3-yl)-1-phenylprop-2-en-1-one

0350-0068 Screening compound: (2E)-3-(1H-indol-3-yl)-1-phenylprop-2-en-1-one
0350-0068 Screening compound: (2E)-3-(1H-indol-3-yl)-1-phenylprop-2-en-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 0350-0068
(2E)-3-(1H-indol-3-yl)-1-phenylprop-2-en-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

0350-0068

Molecular Formula

C17H13NO (C17 H13 NO)

Compound Name

(2E)-3-(1H-indol-3-yl)-1-phenylprop-2-en-1-one

IUPAC name

(2E)-3-(1H-indol-3-yl)-1-phenylprop-2-en-1-one

SMILES

O=C(/C=C/c1c[nH]c2c1cccc2)c1ccccc1

InChI

InChI=1S/C17H13NO/c19-17(13-6-2-1-3-7-13)11-10-14-12-18-16-9-5-4-8-15(14)16/h1-12,18H

InChI Key

XVTDCPBGCCPEBA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00437509

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

247.3

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.734

Distribution Coefficient, logD

3.734

Water Solubility, LogSw

-4.21

Polar Surface Area

23.085

Acid Dissociation Constant (pKa)

17.76

Base Dissociation Constant (pKb)

-3.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0350-0068 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Agro:
  • Agro
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 0350-0068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0350-0068?
Check Price and Availability of 0350-0068, 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 0350-0068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0350-0068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0350-0068
  • 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 0350-0068 available by request