E612-0128 Screening compound: N-(5-chloro-2-methoxyphenyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-2-phenylacetamide

E612-0128 Screening compound: N-(5-chloro-2-methoxyphenyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-2-phenylacetamide
E612-0128 Screening compound: N-(5-chloro-2-methoxyphenyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E612-0128
N-(5-chloro-2-methoxyphenyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-2-phenylacetamide

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

E612-0128

Molecular Formula

C23H19ClN2O3 (C23 H19 ClN2 O3)

Compound Name

N-(5-chloro-2-methoxyphenyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-2-phenylacetamide

IUPAC name

N-(5-chloro-2-methoxyphenyl)-2-(1-oxo-23-dihydro-1H-isoindol-2-yl)-2-phenylacetamide

SMILES

COc(ccc(Cl)c1)c1NC(C(c1ccccc1)N(Cc1c2cccc1)C2=O)=O

InChI

InChI=1S/C23H19ClN2O3/c1-29-20-12-11-17(24)13-19(20)25-22(27)21(15-7-3-2-4-8-15)26-14-16-9-5-6-10-18(16)23(26)28/h2-13,21H,14H2,1H3,(H,25,27)/t21-/m1/s1

InChI Key

GKLOBBRYCKOADH-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD14903323

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.87

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.579

Distribution Coefficient, logD

4.551

Water Solubility, LogSw

-4.79

Polar Surface Area

46.035

Acid Dissociation Constant (pKa)

8.58

Base Dissociation Constant (pKb)

-1.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.00

E612-0128 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with E612-0128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E612-0128?
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What is the minimum amount of E612-0128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E612-0128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E612-0128
  • 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 E612-0128 available by request