E629-1724 Screening compound: 2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-[(4-methylphenyl)methyl]acetamide

E629-1724 Screening compound: 2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-[(4-methylphenyl)methyl]acetamide
E629-1724 Screening compound: 2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-[(4-methylphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E629-1724
2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-[(4-methylphenyl)methyl]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

E629-1724

Molecular Formula

C22H19ClN2OS (C22 H19 ClN2 OS)

Compound Name

2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-[(4-methylphenyl)methyl]acetamide

IUPAC name

2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]-N-[(4-methylphenyl)methyl]acetamide

SMILES

Cc1ccc(CNC(Cn(c(-c2cccs2)c2)c(cc3)c2cc3Cl)=O)cc1

InChI

InChI=1S/C22H19ClN2OS/c1-15-4-6-16(7-5-15)13-24-22(26)14-25-19-9-8-18(23)11-17(19)12-20(25)21-3-2-10-27-21/h2-12H,13-14H2,1H3,(H,24,26)

InChI Key

ZEGJMPAEHOQTLE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27600768

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.92

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.986

Distribution Coefficient, logD

5.986

Water Solubility, LogSw

-6.14

Polar Surface Area

25.911

Acid Dissociation Constant (pKa)

12.80

Base Dissociation Constant (pKb)

-0.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

E629-1724 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with E629-1724 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E629-1724?
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What is the minimum amount of E629-1724 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E629-1724
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E629-1724
  • 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 E629-1724 available by request