E787-0726 Screening compound: 3-(4-ethoxy-3-methoxyphenyl)-N-(3-fluorophenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanamide

E787-0726 Screening compound: 3-(4-ethoxy-3-methoxyphenyl)-N-(3-fluorophenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanamide
E787-0726 Screening compound: 3-(4-ethoxy-3-methoxyphenyl)-N-(3-fluorophenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E787-0726
3-(4-ethoxy-3-methoxyphenyl)-N-(3-fluorophenyl)-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

E787-0726

Molecular Formula

C26H25FN2O4 (C26 H25 FN2 O4)

Compound Name

3-(4-ethoxy-3-methoxyphenyl)-N-(3-fluorophenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanamide

IUPAC name

3-(4-ethoxy-3-methoxyphenyl)-N-(3-fluorophenyl)-3-(1-oxo-23-dihydro-1H-isoindol-2-yl)propanamide

SMILES

CCOc(ccc(C(CC(Nc1cccc(F)c1)=O)N(Cc1c2cccc1)C2=O)c1)c1OC

InChI

InChI=1S/C26H25FN2O4/c1-3-33-23-12-11-17(13-24(23)32-2)22(15-25(30)28-20-9-6-8-19(27)14-20)29-16-18-7-4-5-10-21(18)26(29)31/h4-14,22H,3,15-16H2,1-2H3,(H,28,30)/t22-/m0/s1

InChI Key

OFDCWDXOHUCINC-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD14919598

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.268

Distribution Coefficient, logD

4.267

Water Solubility, LogSw

-4.28

Polar Surface Area

53.694

Acid Dissociation Constant (pKa)

9.97

Base Dissociation Constant (pKb)

-0.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with E787-0726 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E787-0726?
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What is the minimum amount of E787-0726 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E787-0726
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E787-0726
  • 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 E787-0726 available by request