C281-0045 Screening compound: 4-bromo-N-[2-(1H-indol-1-yl)ethyl]benzamide

C281-0045 Screening compound: 4-bromo-N-[2-(1H-indol-1-yl)ethyl]benzamide
C281-0045 Screening compound: 4-bromo-N-[2-(1H-indol-1-yl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C281-0045
4-bromo-N-[2-(1H-indol-1-yl)ethyl]benzamide

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

C281-0045

Molecular Formula

C17H15BrN2O (C17 H15 BrN2 O)

Compound Name

4-bromo-N-[2-(1H-indol-1-yl)ethyl]benzamide

IUPAC name

4-bromo-N-[2-(1H-indol-1-yl)ethyl]benzamide

SMILES

O=C(c(cc1)ccc1Br)NCCn(cc1)c2c1cccc2

InChI

InChI=1S/C17H15BrN2O/c18-15-7-5-14(6-8-15)17(21)19-10-12-20-11-9-13-3-1-2-4-16(13)20/h1-9,11H,10,12H2,(H,19,21)

InChI Key

QGYXZZVMYMWXAP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04463326

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.22

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.055

Distribution Coefficient, logD

4.055

Water Solubility, LogSw

-3.99

Polar Surface Area

26.582

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

-2.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

C281-0045 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anticancer Library (62698 compounds)

Antiviral Annotated Library (21441 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C281-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C281-0045?
Check Price and Availability of C281-0045, 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 C281-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C281-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C281-0045
  • 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 C281-0045 available by request