E787-0251 Screening compound: 3-(4-fluorophenyl)-N-[2-(morpholin-4-yl)ethyl]-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanamide

E787-0251 Screening compound: 3-(4-fluorophenyl)-N-[2-(morpholin-4-yl)ethyl]-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanamide
E787-0251 Screening compound: 3-(4-fluorophenyl)-N-[2-(morpholin-4-yl)ethyl]-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E787-0251
3-(4-fluorophenyl)-N-[2-(morpholin-4-yl)ethyl]-3-(1-oxo-2,3-dihydro-1H-isoindol-2-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

E787-0251

Molecular Formula

C23H26FN3O3 (C23 H26 FN3 O3)

Compound Name

3-(4-fluorophenyl)-N-[2-(morpholin-4-yl)ethyl]-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanamide

IUPAC name

3-(4-fluorophenyl)-N-[2-(morpholin-4-yl)ethyl]-3-(1-oxo-23-dihydro-1H-isoindol-2-yl)propanamide

SMILES

O=C(CC(c(cc1)ccc1F)N(Cc1c2cccc1)C2=O)NCCN1CCOCC1

InChI

InChI=1S/C23H26FN3O3/c24-19-7-5-17(6-8-19)21(27-16-18-3-1-2-4-20(18)23(27)29)15-22(28)25-9-10-26-11-13-30-14-12-26/h1-8,21H,9-16H2,(H,25,28)/t21-/m0/s1

InChI Key

OVXBPMCHZVFPAX-NRFANRHFSA-N

MDL Number (MFCD)

MFCD14919363

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.664

Distribution Coefficient, logD

1.588

Water Solubility, LogSw

-2.59

Polar Surface Area

51.908

Acid Dissociation Constant (pKa)

13.12

Base Dissociation Constant (pKb)

6.68

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

E787-0251 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with E787-0251 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E787-0251?
Check Price and Availability of E787-0251, 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 E787-0251 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E787-0251
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E787-0251
  • 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 E787-0251 available by request