C156-0240 Screening compound: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-3,4-dimethylbenzamide

C156-0240 Screening compound: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-3,4-dimethylbenzamide
C156-0240 Screening compound: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-3,4-dimethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C156-0240
N-[2-(1H-indol-3-ylsulfanyl)ethyl]-3,4-dimethylbenzamide

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

C156-0240

Molecular Formula

C19H20N2OS (C19 H20 N2 OS)

Compound Name

N-[2-(1H-indol-3-ylsulfanyl)ethyl]-3,4-dimethylbenzamide

IUPAC name

N-[2-(1H-indol-3-ylsulfanyl)ethyl]-34-dimethylbenzamide

SMILES

Cc(cc1)c(C)cc1C(NCCSc1c[nH]c2c1cccc2)=O

InChI

InChI=1S/C19H20N2OS/c1-13-7-8-15(11-14(13)2)19(22)20-9-10-23-18-12-21-17-6-4-3-5-16(17)18/h3-8,11-12,21H,9-10H2,1-2H3,(H,20,22)

InChI Key

VTKOYAZYLCFHOU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04458616

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.45

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

4.317

Distribution Coefficient, logD

4.317

Water Solubility, LogSw

-4.18

Polar Surface Area

34.364

Acid Dissociation Constant (pKa)

12.77

Base Dissociation Constant (pKb)

-2.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

C156-0240 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C156-0240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C156-0240?
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What is the minimum amount of C156-0240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C156-0240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C156-0240
  • 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 C156-0240 available by request