0584-0078 Screening compound: methyl 1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

0584-0078 Screening compound: methyl 1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
0584-0078 Screening compound: methyl 1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0584-0078
methyl 1,3-dioxo-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

0584-0078

Molecular Formula

C10H7NO4 (C10 H7 NO4)

Compound Name

methyl 1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

IUPAC name

n/a

SMILES

COC(c(cc1)cc(C(N2)=O)c1C2=O)=O

InChI

InChI=1S/C10H7NO4/c1-15-10(14)5-2-3-6-7(4-5)9(13)11-8(6)12/h2-4H,1H3,(H,11,12,13)

InChI Key

JRFHQEZVUKIDMX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00455850

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

205.17

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.051

Distribution Coefficient, logD

0.847

Water Solubility, LogSw

-2.33

Polar Surface Area

60.178

Acid Dissociation Constant (pKa)

7.62

Base Dissociation Constant (pKb)

-9.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with 0584-0078 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0584-0078?
Check Price and Availability of 0584-0078, 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 0584-0078 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0584-0078
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0584-0078
  • 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 0584-0078 available by request