C430-0333 Screening compound: ethyl 2-{[2-(5-methylpyridin-2-yl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]amino}benzoate

C430-0333 Screening compound: ethyl 2-{[2-(5-methylpyridin-2-yl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]amino}benzoate
C430-0333 Screening compound: ethyl 2-{[2-(5-methylpyridin-2-yl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]amino}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C430-0333
ethyl 2-{[2-(5-methylpyridin-2-yl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]amino}benzoate

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

C430-0333

Molecular Formula

C23H21N3O3 (C23 H21 N3 O3)

Compound Name

ethyl 2-{[2-(5-methylpyridin-2-yl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]amino}benzoate

IUPAC name

ethyl 2-{[2-(5-methylpyridin-2-yl)-3-oxo-23-dihydro-1H-isoindol-1-yl]amino}benzoate

SMILES

CCOC(c(cccc1)c1NC(c(cccc1)c1C1=O)N1c1ncc(C)cc1)=O

InChI

InChI=1S/C23H21N3O3/c1-3-29-23(28)18-10-6-7-11-19(18)25-21-16-8-4-5-9-17(16)22(27)26(21)20-13-12-15(2)14-24-20/h4-14,21,25H,3H2,1-2H3/t21-/m1/s1

InChI Key

GBDIUKDUPBKDGF-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD14756461

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.610

Distribution Coefficient, logD

4.610

Water Solubility, LogSw

-4.29

Polar Surface Area

53.047

Acid Dissociation Constant (pKa)

12.96

Base Dissociation Constant (pKb)

2.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.40

C430-0333 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C430-0333 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C430-0333?
Check Price and Availability of C430-0333, 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 C430-0333 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C430-0333
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C430-0333
  • 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 C430-0333 available by request