C614-0362 Screening compound: 2-(4-chlorophenyl)-3-[(4-fluorophenyl)amino]-2,3-dihydro-1H-isoindol-1-one

C614-0362 Screening compound: 2-(4-chlorophenyl)-3-[(4-fluorophenyl)amino]-2,3-dihydro-1H-isoindol-1-one
C614-0362 Screening compound: 2-(4-chlorophenyl)-3-[(4-fluorophenyl)amino]-2,3-dihydro-1H-isoindol-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C614-0362
2-(4-chlorophenyl)-3-[(4-fluorophenyl)amino]-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

C614-0362

Molecular Formula

C20H14ClFN2O (C20 H14 ClFN2 O)

Compound Name

2-(4-chlorophenyl)-3-[(4-fluorophenyl)amino]-2,3-dihydro-1H-isoindol-1-one

IUPAC name

2-(4-chlorophenyl)-3-[(4-fluorophenyl)amino]-23-dihydro-1H-isoindol-1-one

SMILES

O=C(c1c(C2Nc(cc3)ccc3F)cccc1)N2c(cc1)ccc1Cl

InChI

InChI=1S/C20H14ClFN2O/c21-13-5-11-16(12-6-13)24-19(23-15-9-7-14(22)8-10-15)17-3-1-2-4-18(17)20(24)25/h1-12,19,23H/t19-/m0/s1

InChI Key

PDHGDVUVCCEXGY-IBGZPJMESA-N

MDL Number (MFCD)

MFCD14776151

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.8

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.813

Distribution Coefficient, logD

4.813

Water Solubility, LogSw

-5.08

Polar Surface Area

24.390

Acid Dissociation Constant (pKa)

14.70

Base Dissociation Constant (pKb)

-0.01

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

5.00

C614-0362 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 C614-0362 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C614-0362?
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What is the minimum amount of C614-0362 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C614-0362
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C614-0362
  • 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 C614-0362 available by request