4483-1269 Screening compound: 2-(3-nitrophenyl)-2-oxoethyl 2-(2,5-dichlorophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

4483-1269 Screening compound: 2-(3-nitrophenyl)-2-oxoethyl 2-(2,5-dichlorophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
4483-1269 Screening compound: 2-(3-nitrophenyl)-2-oxoethyl 2-(2,5-dichlorophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4483-1269
2-(3-nitrophenyl)-2-oxoethyl 2-(2,5-dichlorophenyl)-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

4483-1269

Molecular Formula

C23H12Cl2N2O7 (C23 H12 Cl2 N2 O7)

Compound Name

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

IUPAC name

2-(3-nitrophenyl)-2-oxoethyl 2-(25-dichlorophenyl)-13-dioxo-23-dihydro-1H-isoindole-5-carboxylate

SMILES

[O-][N+](c1cccc(C(COC(c(cc2)cc(C(N3c(cc(cc4)Cl)c4Cl)=O)c2C3=O)=O)=O)c1)=O

InChI

InChI=1S/C23H12Cl2N2O7/c24-14-5-7-18(25)19(10-14)26-21(29)16-6-4-13(9-17(16)22(26)30)23(31)34-11-20(28)12-2-1-3-15(8-12)27(32)33/h1-10H,11H2

InChI Key

GVOFZWSWESDZHA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01068384

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.26

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.257

Distribution Coefficient, logD

5.257

Water Solubility, LogSw

-5.77

Polar Surface Area

96.065

Acid Dissociation Constant (pKa)

22.85

Base Dissociation Constant (pKb)

-10.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

References: we are preparing a list of scientific research reports with 4483-1269 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4483-1269?
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What is the minimum amount of 4483-1269 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4483-1269
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4483-1269
  • 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 4483-1269 available by request