8013-5771 Screening compound: 2-(1H-indol-3-yl)-2-oxo-N-(2-phenoxyethyl)acetamide

8013-5771 Screening compound: 2-(1H-indol-3-yl)-2-oxo-N-(2-phenoxyethyl)acetamide
8013-5771 Screening compound: 2-(1H-indol-3-yl)-2-oxo-N-(2-phenoxyethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-5771
2-(1H-indol-3-yl)-2-oxo-N-(2-phenoxyethyl)acetamide

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

8013-5771

Molecular Formula

C18H16N2O3 (C18 H16 N2 O3)

Compound Name

2-(1H-indol-3-yl)-2-oxo-N-(2-phenoxyethyl)acetamide

IUPAC name

2-(1H-indol-3-yl)-2-oxo-N-(2-phenoxyethyl)acetamide

SMILES

O=C(C(NCCOc1ccccc1)=O)c1c[nH]c2c1cccc2

InChI

InChI=1S/C18H16N2O3/c21-17(15-12-20-16-9-5-4-8-14(15)16)18(22)19-10-11-23-13-6-2-1-3-7-13/h1-9,12,20H,10-11H2,(H,19,22)

InChI Key

KASRRSAOIITHBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03766845

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.240

Distribution Coefficient, logD

3.240

Water Solubility, LogSw

-3.56

Polar Surface Area

55.520

Acid Dissociation Constant (pKa)

12.66

Base Dissociation Constant (pKb)

0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

8013-5771 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

Cardiovascular Library (22201 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 8013-5771 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-5771?
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What is the minimum amount of 8013-5771 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-5771
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-5771
  • 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 8013-5771 available by request