2747-0014 Screening compound: 2-(3-chloro-4-methylphenyl)-5-{[2-(3-chloro-4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}-2,3-dihydro-1H-isoindole-1,3-dione

2747-0014 Screening compound: 2-(3-chloro-4-methylphenyl)-5-{[2-(3-chloro-4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}-2,3-dihydro-1H-isoindole-1,3-dione
2747-0014 Screening compound: 2-(3-chloro-4-methylphenyl)-5-{[2-(3-chloro-4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}-2,3-dihydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 2747-0014
2-(3-chloro-4-methylphenyl)-5-{[2-(3-chloro-4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}-2,3-dihydro-1H-isoindole-1,3-dione

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

2747-0014

Molecular Formula

C30H18Cl2N2O5 (C30 H18 Cl2 N2 O5)

Compound Name

2-(3-chloro-4-methylphenyl)-5-{[2-(3-chloro-4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}-2,3-dihydro-1H-isoindole-1,3-dione

IUPAC name

2-(3-chloro-4-methylphenyl)-5-{[2-(3-chloro-4-methylphenyl)-13-dioxo-23-dihydro-1H-isoindol-5-yl]oxy}-23-dihydro-1H-isoindole-13-dione

SMILES

Cc(ccc(N(C(c(cc1)c2cc1Oc(cc1)cc(C(N3c4cc(Cl)c(C)cc4)=O)c1C3=O)=O)C2=O)c1)c1Cl

InChI

InChI=1S/C30H18Cl2N2O5/c1-15-3-5-17(11-25(15)31)33-27(35)21-9-7-19(13-23(21)29(33)37)39-20-8-10-22-24(14-20)30(38)34(28(22)36)18-6-4-16(2)26(32)12-18/h3-14H,1-2H3

InChI Key

AVCPHJLVGNBQBP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02269793

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

557.39

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

7.671

Distribution Coefficient, logD

7.671

Water Solubility, LogSw

-6.64

Polar Surface Area

64.269

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

References: we are preparing a list of scientific research reports with 2747-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2747-0014?
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What is the minimum amount of 2747-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2747-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2747-0014
  • 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 2747-0014 available by request