E155-1128 Screening compound: N-(2,3-dimethylphenyl)-N'-[2-(pyridin-3-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl]ethanediamide

E155-1128 Screening compound: N-(2,3-dimethylphenyl)-N'-[2-(pyridin-3-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl]ethanediamide
E155-1128 Screening compound: N-(2,3-dimethylphenyl)-N'-[2-(pyridin-3-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl]ethanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E155-1128
N-(2,3-dimethylphenyl)-N'-[2-(pyridin-3-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl]ethanediamide

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

E155-1128

Molecular Formula

C26H28N4O2 (C26 H28 N4 O2)

Compound Name

N-(2,3-dimethylphenyl)-N'-[2-(pyridin-3-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl]ethanediamide

IUPAC name

N-(23-dimethylphenyl)-N'-[2-(pyridin-3-yl)-2-(1234-tetrahydroisoquinolin-2-yl)ethyl]ethanediamide

SMILES

Cc1cccc(NC(C(NCC(c2cnccc2)N(CC2)Cc3c2cccc3)=O)=O)c1C

InChI

InChI=1S/C26H28N4O2/c1-18-7-5-11-23(19(18)2)29-26(32)25(31)28-16-24(21-10-6-13-27-15-21)30-14-12-20-8-3-4-9-22(20)17-30/h3-11,13,15,24H,12,14,16-17H2,1-2H3,(H,28,31)(H,29,32)/t24-/m0/s1

InChI Key

BDTBEQVMZUVBTM-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD07716766

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.425

Distribution Coefficient, logD

3.320

Water Solubility, LogSw

-3.02

Polar Surface Area

59.486

Acid Dissociation Constant (pKa)

7.98

Base Dissociation Constant (pKb)

5.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.90

E155-1128 in Drug Discovery

Included in Screening Libraries

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E155-1128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E155-1128?
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What is the minimum amount of E155-1128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E155-1128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E155-1128
  • 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 E155-1128 available by request