E787-0077 Screening compound: N-(3-acetylphenyl)-3-(4-methoxyphenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanamide

E787-0077 Screening compound: N-(3-acetylphenyl)-3-(4-methoxyphenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanamide
E787-0077 Screening compound: N-(3-acetylphenyl)-3-(4-methoxyphenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E787-0077
N-(3-acetylphenyl)-3-(4-methoxyphenyl)-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

E787-0077

Molecular Formula

C26H24N2O4 (C26 H24 N2 O4)

Compound Name

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

IUPAC name

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

SMILES

CC(c1cccc(NC(CC(c(cc2)ccc2OC)N(Cc2c3cccc2)C3=O)=O)c1)=O

InChI

InChI=1S/C26H24N2O4/c1-17(29)19-7-5-8-21(14-19)27-25(30)15-24(18-10-12-22(32-2)13-11-18)28-16-20-6-3-4-9-23(20)26(28)31/h3-14,24H,15-16H2,1-2H3,(H,27,30)/t24-/m0/s1

InChI Key

HZNGXOVJNCZSGB-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD14919249

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.829

Distribution Coefficient, logD

3.828

Water Solubility, LogSw

-4.08

Polar Surface Area

60.224

Acid Dissociation Constant (pKa)

10.13

Base Dissociation Constant (pKb)

-1.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.20

E787-0077 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cardiovascular

References: we are preparing a list of scientific research reports with E787-0077 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E787-0077?
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What is the minimum amount of E787-0077 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E787-0077
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E787-0077
  • 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 E787-0077 available by request