2293-0323 Screening compound: methyl 4-[2-(4-chlorophenyl)-3-(4-fluorophenyl)-4,6-dioxo-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate

2293-0323 Screening compound: methyl 4-[2-(4-chlorophenyl)-3-(4-fluorophenyl)-4,6-dioxo-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate
2293-0323 Screening compound: methyl 4-[2-(4-chlorophenyl)-3-(4-fluorophenyl)-4,6-dioxo-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2293-0323
methyl 4-[2-(4-chlorophenyl)-3-(4-fluorophenyl)-4,6-dioxo-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate

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

2293-0323

Molecular Formula

C25H18ClFN2O5 (C25 H18 ClFN2 O5)

Compound Name

methyl 4-[2-(4-chlorophenyl)-3-(4-fluorophenyl)-4,6-dioxo-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate

IUPAC name

methyl 4-[2-(4-chlorophenyl)-3-(4-fluorophenyl)-46-dioxo-hexahydro-2H-pyrrolo[34-d][12]oxazol-5-yl]benzoate

SMILES

COC(c(cc1)ccc1N(C(C1C(c(cc2)ccc2F)N(c(cc2)ccc2Cl)OC11)=O)C1=O)=O

InChI

InChI=1S/C25H18ClFN2O5/c1-33-25(32)15-4-10-18(11-5-15)28-23(30)20-21(14-2-8-17(27)9-3-14)29(34-22(20)24(28)31)19-12-6-16(26)7-13-19/h2-13,20-22H,1H3

InChI Key

MKVKUCLVLAUIQG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01167322

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.88

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.040

Distribution Coefficient, logD

4.040

Water Solubility, LogSw

-4.89

Polar Surface Area

64.807

Acid Dissociation Constant (pKa)

12.68

Base Dissociation Constant (pKb)

-4.55

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

16.00

2293-0323 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 2293-0323 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2293-0323?
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What is the minimum amount of 2293-0323 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2293-0323
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2293-0323
  • 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 2293-0323 available by request