E612-0926 Screening compound: 4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]pentanamide

E612-0926 Screening compound: 4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]pentanamide
E612-0926 Screening compound: 4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E612-0926
4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]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

E612-0926

Molecular Formula

C21H29N3O3 (C21 H29 N3 O3)

Compound Name

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

IUPAC name

4-methyl-2-(1-oxo-23-dihydro-1H-isoindol-2-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]pentanamide

SMILES

CC(C)CC(C(NCCCN(CCC1)C1=O)=O)N(Cc1c2cccc1)C2=O

InChI

InChI=1S/C21H29N3O3/c1-15(2)13-18(24-14-16-7-3-4-8-17(16)21(24)27)20(26)22-10-6-12-23-11-5-9-19(23)25/h3-4,7-8,15,18H,5-6,9-14H2,1-2H3,(H,22,26)/t18-/m0/s1

InChI Key

LJGHQNZKJHUHPD-SFHVURJKSA-N

MDL Number (MFCD)

MFCD14903572

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.500

Distribution Coefficient, logD

1.500

Water Solubility, LogSw

-2.39

Polar Surface Area

58.015

Acid Dissociation Constant (pKa)

15.33

Base Dissociation Constant (pKb)

1.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.10

E612-0926 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with E612-0926 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E612-0926?
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What is the minimum amount of E612-0926 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E612-0926
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E612-0926
  • 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 E612-0926 available by request