E612-1020 Screening compound: N-[2-(4-ethoxyphenyl)ethyl]-4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)pentanamide

E612-1020 Screening compound: N-[2-(4-ethoxyphenyl)ethyl]-4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)pentanamide
E612-1020 Screening compound: N-[2-(4-ethoxyphenyl)ethyl]-4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E612-1020
N-[2-(4-ethoxyphenyl)ethyl]-4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)pentanamide

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

E612-1020

Molecular Formula

C24H30N2O3 (C24 H30 N2 O3)

Compound Name

N-[2-(4-ethoxyphenyl)ethyl]-4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)pentanamide

IUPAC name

N-[2-(4-ethoxyphenyl)ethyl]-4-methyl-2-(1-oxo-23-dihydro-1H-isoindol-2-yl)pentanamide

SMILES

CCOc1ccc(CCNC(C(CC(C)C)N(Cc2c3cccc2)C3=O)=O)cc1

InChI

InChI=1S/C24H30N2O3/c1-4-29-20-11-9-18(10-12-20)13-14-25-23(27)22(15-17(2)3)26-16-19-7-5-6-8-21(19)24(26)28/h5-12,17,22H,4,13-16H2,1-3H3,(H,25,27)/t22-/m0/s1

InChI Key

QRUKKLUJGFZWCK-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD14903621

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.979

Distribution Coefficient, logD

3.979

Water Solubility, LogSw

-4.05

Polar Surface Area

47.626

Acid Dissociation Constant (pKa)

14.19

Base Dissociation Constant (pKb)

0.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

E612-1020 in Drug Discovery

Included in Screening Libraries

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with E612-1020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E612-1020?
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What is the minimum amount of E612-1020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E612-1020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E612-1020
  • 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 E612-1020 available by request