E612-0491 Screening compound: N-(2,5-DIMETHYLPHENYL)-2-(1-OXO-2,3-DIHYDRO-1H-ISOINDOL-2-YL)-3-PHENYLPROPANAMIDE

E612-0491 Screening compound: N-(2,5-DIMETHYLPHENYL)-2-(1-OXO-2,3-DIHYDRO-1H-ISOINDOL-2-YL)-3-PHENYLPROPANAMIDE
E612-0491 Screening compound: N-(2,5-DIMETHYLPHENYL)-2-(1-OXO-2,3-DIHYDRO-1H-ISOINDOL-2-YL)-3-PHENYLPROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound E612-0491
N-(2,5-DIMETHYLPHENYL)-2-(1-OXO-2,3-DIHYDRO-1H-ISOINDOL-2-YL)-3-PHENYLPROPANAMIDE

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

E612-0491

Molecular Formula

C25H24N2O2 (C25 H24 N2 O2)

Compound Name

N-(2,5-DIMETHYLPHENYL)-2-(1-OXO-2,3-DIHYDRO-1H-ISOINDOL-2-YL)-3-PHENYLPROPANAMIDE

IUPAC name

n/a

SMILES

Cc1cc(NC(C(Cc2ccccc2)N(Cc2c3cccc2)C3=O)=O)c(C)cc1

InChI

InChI=1S/C25H24N2O2/c1-17-12-13-18(2)22(14-17)26-24(28)23(15-19-8-4-3-5-9-19)27-16-20-10-6-7-11-21(20)25(27)29/h3-14,23H,15-16H2,1-2H3,(H,26,28)/t23-/m0/s1

InChI Key

FBBOZEMYDYIRFL-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD14903403

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.609

Distribution Coefficient, logD

4.609

Water Solubility, LogSw

-4.43

Polar Surface Area

38.369

Acid Dissociation Constant (pKa)

11.86

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

E612-0491 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-infective Library (19449 compounds)

Anticancer Library (62698 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer

References: we are preparing a list of scientific research reports with E612-0491 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E612-0491?
Check Price and Availability of E612-0491, 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 E612-0491 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E612-0491
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E612-0491
  • 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 E612-0491 available by request