E647-1112 Screening compound: N-(2-methoxyethyl)-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)propanamide

E647-1112 Screening compound: N-(2-methoxyethyl)-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)propanamide
E647-1112 Screening compound: N-(2-methoxyethyl)-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E647-1112
N-(2-methoxyethyl)-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)propanamide

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

E647-1112

Molecular Formula

C16H22N2O3 (C16 H22 N2 O3)

Compound Name

N-(2-methoxyethyl)-2-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)propanamide

IUPAC name

N-(2-methoxyethyl)-2-(2-oxo-2345-tetrahydro-1H-1-benzazepin-1-yl)propanamide

SMILES

CC(C(NCCOC)=O)N(c1c(CCC2)cccc1)C2=O

InChI

InChI=1S/C16H22N2O3/c1-12(16(20)17-10-11-21-2)18-14-8-4-3-6-13(14)7-5-9-15(18)19/h3-4,6,8,12H,5,7,9-11H2,1-2H3,(H,17,20)/t12-/m0/s1

InChI Key

PJLMKLAXENIFFY-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD27600942

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.36

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

1.443

Distribution Coefficient, logD

1.443

Water Solubility, LogSw

-1.97

Polar Surface Area

48.431

Acid Dissociation Constant (pKa)

14.19

Base Dissociation Constant (pKb)

-0.08

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

E647-1112 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with E647-1112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E647-1112?
Check Price and Availability of E647-1112, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E647-1112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E647-1112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E647-1112
  • 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 E647-1112 available by request