K784-9597 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-methoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-isoindole-1-carboxamide

K784-9597 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-methoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-isoindole-1-carboxamide
K784-9597 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-methoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-isoindole-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-9597
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-methoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-isoindole-1-carboxamide

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

K784-9597

Molecular Formula

C27H28N2O5 (C27 H28 N2 O5)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-methoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-isoindole-1-carboxamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-2-[(2-methoxyphenyl)methyl]-3-oxo-23-dihydro-1H-isoindole-1-carboxamide

SMILES

COc1c(CN(C(C(NCCc(cc2)cc(OC)c2OC)=O)c2c3cccc2)C3=O)cccc1

InChI

InChI=1S/C27H28N2O5/c1-32-22-11-7-4-8-19(22)17-29-25(20-9-5-6-10-21(20)27(29)31)26(30)28-15-14-18-12-13-23(33-2)24(16-18)34-3/h4-13,16,25H,14-15,17H2,1-3H3,(H,28,30)/t25-/m0/s1

InChI Key

BVJGQSMFZMRWCJ-VWLOTQADSA-N

MDL Number (MFCD)

MFCD03830740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.185

Distribution Coefficient, logD

3.185

Water Solubility, LogSw

-3.54

Polar Surface Area

63.435

Acid Dissociation Constant (pKa)

13.83

Base Dissociation Constant (pKb)

-0.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.90

K784-9597 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Cancer
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Ion Channels
  • Phosphatases
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with K784-9597 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-9597?
Check Price and Availability of K784-9597, 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 K784-9597 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-9597
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-9597
  • 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 K784-9597 available by request