E647-4240 Screening compound: N-(2-fluoro-4-methylphenyl)-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)acetamide

E647-4240 Screening compound: N-(2-fluoro-4-methylphenyl)-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)acetamide
E647-4240 Screening compound: N-(2-fluoro-4-methylphenyl)-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E647-4240
N-(2-fluoro-4-methylphenyl)-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-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

E647-4240

Molecular Formula

C19H19FN2O2 (C19 H19 FN2 O2)

Compound Name

N-(2-fluoro-4-methylphenyl)-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)acetamide

IUPAC name

N-(2-fluoro-4-methylphenyl)-2-(2-oxo-2345-tetrahydro-1H-1-benzazepin-1-yl)acetamide

SMILES

Cc(cc1)cc(F)c1NC(CN(c1c(CCC2)cccc1)C2=O)=O

InChI

InChI=1S/C19H19FN2O2/c1-13-9-10-16(15(20)11-13)21-18(23)12-22-17-7-3-2-5-14(17)6-4-8-19(22)24/h2-3,5,7,9-11H,4,6,8,12H2,1H3,(H,21,23)

InChI Key

DMAYXNXSGHVREF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27601014

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.37

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

3.934

Distribution Coefficient, logD

3.933

Water Solubility, LogSw

-3.92

Polar Surface Area

38.401

Acid Dissociation Constant (pKa)

10.50

Base Dissociation Constant (pKb)

0.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

E647-4240 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with E647-4240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E647-4240?
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What is the minimum amount of E647-4240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E647-4240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E647-4240
  • 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 E647-4240 available by request