E612-1549 Screening compound: N-(4-bromo-3-methylphenyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

E612-1549 Screening compound: N-(4-bromo-3-methylphenyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)acetamide
E612-1549 Screening compound: N-(4-bromo-3-methylphenyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E612-1549
N-(4-bromo-3-methylphenyl)-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

E612-1549

Molecular Formula

C17H15BrN2O2 (C17 H15 BrN2 O2)

Compound Name

N-(4-bromo-3-methylphenyl)-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

IUPAC name

N-(4-bromo-3-methylphenyl)-2-(1-oxo-23-dihydro-1H-isoindol-2-yl)acetamide

SMILES

Cc(cc(cc1)NC(CN(Cc2c3cccc2)C3=O)=O)c1Br

InChI

InChI=1S/C17H15BrN2O2/c1-11-8-13(6-7-15(11)18)19-16(21)10-20-9-12-4-2-3-5-14(12)17(20)22/h2-8H,9-10H2,1H3,(H,19,21)

InChI Key

DOGVBJJSWMHLIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14903791

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.22

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.557

Distribution Coefficient, logD

3.557

Water Solubility, LogSw

-3.69

Polar Surface Area

40.034

Acid Dissociation Constant (pKa)

11.16

Base Dissociation Constant (pKb)

0.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

E612-1549 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with E612-1549 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E612-1549?
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What is the minimum amount of E612-1549 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E612-1549
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E612-1549
  • 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 E612-1549 available by request