1021-0859 Screening compound: 4-methylphenyl 1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindole-5-carboxylate

1021-0859 Screening compound: 4-methylphenyl 1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindole-5-carboxylate
1021-0859 Screening compound: 4-methylphenyl 1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1021-0859
4-methylphenyl 1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindole-5-carboxylate

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

1021-0859

Molecular Formula

C22H15NO4 (C22 H15 NO4)

Compound Name

4-methylphenyl 1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindole-5-carboxylate

IUPAC name

4-methylphenyl 13-dioxo-2-phenyl-23-dihydro-1H-isoindole-5-carboxylate

SMILES

Cc(cc1)ccc1OC(c(cc1)cc(C(N2c3ccccc3)=O)c1C2=O)=O

InChI

InChI=1S/C22H15NO4/c1-14-7-10-17(11-8-14)27-22(26)15-9-12-18-19(13-15)21(25)23(20(18)24)16-5-3-2-4-6-16/h2-13H,1H3

InChI Key

HIBJKDLHUJMMSP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00591004

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.267

Distribution Coefficient, logD

4.267

Water Solubility, LogSw

-4.41

Polar Surface Area

49.258

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-8.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

References: we are preparing a list of scientific research reports with 1021-0859 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1021-0859?
Check Price and Availability of 1021-0859, 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 1021-0859 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1021-0859
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1021-0859
  • 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 1021-0859 available by request