C156-0091 Screening compound: N-(2-{[2-(4-bromophenyl)-1H-indol-3-yl]sulfanyl}ethyl)acetamide

C156-0091 Screening compound: N-(2-{[2-(4-bromophenyl)-1H-indol-3-yl]sulfanyl}ethyl)acetamide
C156-0091 Screening compound: N-(2-{[2-(4-bromophenyl)-1H-indol-3-yl]sulfanyl}ethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C156-0091
N-(2-{[2-(4-bromophenyl)-1H-indol-3-yl]sulfanyl}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

C156-0091

Molecular Formula

C18H17BrN2OS (C18 H17 BrN2 OS)

Compound Name

N-(2-{[2-(4-bromophenyl)-1H-indol-3-yl]sulfanyl}ethyl)acetamide

IUPAC name

N-(2-{[2-(4-bromophenyl)-1H-indol-3-yl]sulfanyl}ethyl)acetamide

SMILES

CC(NCCSc1c(-c(cc2)ccc2Br)[nH]c2c1cccc2)=O

InChI

InChI=1S/C18H17BrN2OS/c1-12(22)20-10-11-23-18-15-4-2-3-5-16(15)21-17(18)13-6-8-14(19)9-7-13/h2-9,21H,10-11H2,1H3,(H,20,22)

InChI Key

PKIHHQBMZNEDLT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04458811

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.32

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.619

Distribution Coefficient, logD

3.619

Water Solubility, LogSw

-3.81

Polar Surface Area

34.512

Acid Dissociation Constant (pKa)

15.17

Base Dissociation Constant (pKb)

0.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

C156-0091 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C156-0091 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C156-0091?
Check Price and Availability of C156-0091, 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 C156-0091 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C156-0091
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C156-0091
  • 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 C156-0091 available by request