4964-0999 Screening compound: 2-(4-bromophenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide

4964-0999 Screening compound: 2-(4-bromophenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide
4964-0999 Screening compound: 2-(4-bromophenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4964-0999
2-(4-bromophenoxy)-N-[2-(1H-indol-3-yl)ethyl]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

4964-0999

Molecular Formula

C18H17BrN2O2 (C18 H17 BrN2 O2)

Compound Name

2-(4-bromophenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide

IUPAC name

2-(4-bromophenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide

SMILES

O=C(COc(cc1)ccc1Br)NCCc1c[nH]c2c1cccc2

InChI

InChI=1S/C18H17BrN2O2/c19-14-5-7-15(8-6-14)23-12-18(22)20-10-9-13-11-21-17-4-2-1-3-16(13)17/h1-8,11,21H,9-10,12H2,(H,20,22)

InChI Key

VVLZEYQMIJTNNZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00170646

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

373.25

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.538

Distribution Coefficient, logD

3.538

Water Solubility, LogSw

-3.60

Polar Surface Area

41.650

Acid Dissociation Constant (pKa)

14.46

Base Dissociation Constant (pKb)

0.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

4964-0999 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
Targets:
  • Proteases
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4964-0999 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4964-0999?
Check Price and Availability of 4964-0999, 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 4964-0999 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4964-0999
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4964-0999
  • 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 4964-0999 available by request