E787-0863 Screening compound: N-(2-fluorophenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-3-(3,4,5-trimethoxyphenyl)propanamide

E787-0863 Screening compound: N-(2-fluorophenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-3-(3,4,5-trimethoxyphenyl)propanamide
E787-0863 Screening compound: N-(2-fluorophenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-3-(3,4,5-trimethoxyphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E787-0863
N-(2-fluorophenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-3-(3,4,5-trimethoxyphenyl)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

E787-0863

Molecular Formula

C26H25FN2O5 (C26 H25 FN2 O5)

Compound Name

N-(2-fluorophenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)-3-(3,4,5-trimethoxyphenyl)propanamide

IUPAC name

N-(2-fluorophenyl)-3-(1-oxo-23-dihydro-1H-isoindol-2-yl)-3-(345-trimethoxyphenyl)propanamide

SMILES

COc1cc(C(CC(Nc(cccc2)c2F)=O)N(Cc2c3cccc2)C3=O)cc(OC)c1OC

InChI

InChI=1S/C26H25FN2O5/c1-32-22-12-17(13-23(33-2)25(22)34-3)21(14-24(30)28-20-11-7-6-10-19(20)27)29-15-16-8-4-5-9-18(16)26(29)31/h4-13,21H,14-15H2,1-3H3,(H,28,30)/t21-/m0/s1

InChI Key

BHFSQMZKRVWLPD-NRFANRHFSA-N

MDL Number (MFCD)

MFCD14919663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.638

Distribution Coefficient, logD

3.637

Water Solubility, LogSw

-3.98

Polar Surface Area

61.134

Acid Dissociation Constant (pKa)

9.96

Base Dissociation Constant (pKb)

-1.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with E787-0863 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E787-0863?
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What is the minimum amount of E787-0863 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E787-0863
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E787-0863
  • 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 E787-0863 available by request