E612-1534 Screening compound: N-(3-methylbutyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

E612-1534 Screening compound: N-(3-methylbutyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)acetamide
E612-1534 Screening compound: N-(3-methylbutyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E612-1534
N-(3-methylbutyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)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

E612-1534

Molecular Formula

C15H20N2O2 (C15 H20 N2 O2)

Compound Name

N-(3-methylbutyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

IUPAC name

N-(3-methylbutyl)-2-(1-oxo-23-dihydro-1H-isoindol-2-yl)acetamide

SMILES

CC(C)CCNC(CN(Cc1c2cccc1)C2=O)=O

InChI

InChI=1S/C15H20N2O2/c1-11(2)7-8-16-14(18)10-17-9-12-5-3-4-6-13(12)15(17)19/h3-6,11H,7-10H2,1-2H3,(H,16,18)

InChI Key

LMYXSPMFAJIEAH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14903781

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

260.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.828

Distribution Coefficient, logD

1.828

Water Solubility, LogSw

-2.75

Polar Surface Area

41.469

Acid Dissociation Constant (pKa)

14.46

Base Dissociation Constant (pKb)

3.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.70

E612-1534 in Drug Discovery

Included in Screening Libraries

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

Allosteric Kinases Inhibitors Library (23117 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Nervous system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E612-1534 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E612-1534?
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What is the minimum amount of E612-1534 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E612-1534
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E612-1534
  • 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 E612-1534 available by request