4483-1420 Screening compound: 2-(4-nitrophenyl)-2-oxoethyl 2-(4-acetylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

4483-1420 Screening compound: 2-(4-nitrophenyl)-2-oxoethyl 2-(4-acetylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
4483-1420 Screening compound: 2-(4-nitrophenyl)-2-oxoethyl 2-(4-acetylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4483-1420
2-(4-nitrophenyl)-2-oxoethyl 2-(4-acetylphenyl)-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

4483-1420

Molecular Formula

C25H16N2O8 (C25 H16 N2 O8)

Compound Name

2-(4-nitrophenyl)-2-oxoethyl 2-(4-acetylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

IUPAC name

2-(4-nitrophenyl)-2-oxoethyl 2-(4-acetylphenyl)-13-dioxo-23-dihydro-1H-isoindole-5-carboxylate

SMILES

CC(c(cc1)ccc1N(C(c(cc1)c2cc1C(OCC(c(cc1)ccc1[N+]([O-])=O)=O)=O)=O)C2=O)=O

InChI

InChI=1S/C25H16N2O8/c1-14(28)15-2-7-18(8-3-15)26-23(30)20-11-6-17(12-21(20)24(26)31)25(32)35-13-22(29)16-4-9-19(10-5-16)27(33)34/h2-12H,13H2,1H3

InChI Key

JBBPCPSQYWODRP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01138180

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.41

Hydrogen Bond Acceptors Count

15.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.422

Distribution Coefficient, logD

3.422

Water Solubility, LogSw

-3.75

Polar Surface Area

110.193

Acid Dissociation Constant (pKa)

21.69

Base Dissociation Constant (pKb)

-10.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

References: we are preparing a list of scientific research reports with 4483-1420 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4483-1420?
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What is the minimum amount of 4483-1420 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4483-1420
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4483-1420
  • 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 4483-1420 available by request