C430-0341 Screening compound: 3-[(3,4-dimethylphenyl)amino]-2-(5-methylpyridin-2-yl)-2,3-dihydro-1H-isoindol-1-one

C430-0341 Screening compound: 3-[(3,4-dimethylphenyl)amino]-2-(5-methylpyridin-2-yl)-2,3-dihydro-1H-isoindol-1-one
C430-0341 Screening compound: 3-[(3,4-dimethylphenyl)amino]-2-(5-methylpyridin-2-yl)-2,3-dihydro-1H-isoindol-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C430-0341
3-[(3,4-dimethylphenyl)amino]-2-(5-methylpyridin-2-yl)-2,3-dihydro-1H-isoindol-1-one

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

C430-0341

Molecular Formula

C22H21N3O (C22 H21 N3 O)

Compound Name

3-[(3,4-dimethylphenyl)amino]-2-(5-methylpyridin-2-yl)-2,3-dihydro-1H-isoindol-1-one

IUPAC name

3-[(34-dimethylphenyl)amino]-2-(5-methylpyridin-2-yl)-23-dihydro-1H-isoindol-1-one

SMILES

Cc(cc1)cnc1N(C(c1c2cccc1)Nc1cc(C)c(C)cc1)C2=O

InChI

InChI=1S/C22H21N3O/c1-14-8-11-20(23-13-14)25-21(18-6-4-5-7-19(18)22(25)26)24-17-10-9-15(2)16(3)12-17/h4-13,21,24H,1-3H3/t21-/m1/s1

InChI Key

UYBPDKGYFNDNOO-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD14756463

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.103

Distribution Coefficient, logD

5.103

Water Solubility, LogSw

-4.71

Polar Surface Area

32.991

Acid Dissociation Constant (pKa)

14.51

Base Dissociation Constant (pKb)

2.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.20

C430-0341 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C430-0341 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C430-0341?
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What is the minimum amount of C430-0341 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C430-0341
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C430-0341
  • 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 C430-0341 available by request