3584-1291 Screening compound: (4E)-4-({5-chloro-2-[2-(2-phenoxyethoxy)ethoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione

3584-1291 Screening compound: (4E)-4-({5-chloro-2-[2-(2-phenoxyethoxy)ethoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione
3584-1291 Screening compound: (4E)-4-({5-chloro-2-[2-(2-phenoxyethoxy)ethoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3584-1291
(4E)-4-({5-chloro-2-[2-(2-phenoxyethoxy)ethoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione

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

3584-1291

Molecular Formula

C26H23ClN2O5 (C26 H23 ClN2 O5)

Compound Name

(4E)-4-({5-chloro-2-[2-(2-phenoxyethoxy)ethoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione

IUPAC name

(4E)-4-({5-chloro-2-[2-(2-phenoxyethoxy)ethoxy]phenyl}methylidene)-1-phenylpyrazolidine-35-dione

SMILES

O=C(/C(/C1=O)=C\c(cc(cc2)Cl)c2OCCOCCOc2ccccc2)NN1c1ccccc1

InChI

InChI=1S/C26H23ClN2O5/c27-20-11-12-24(34-16-14-32-13-15-33-22-9-5-2-6-10-22)19(17-20)18-23-25(30)28-29(26(23)31)21-7-3-1-4-8-21/h1-12,17-18H,13-16H2,(H,28,30)

InChI Key

JPWOLFZOMNMLSM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02121447

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.93

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.396

Distribution Coefficient, logD

4.363

Water Solubility, LogSw

-4.63

Polar Surface Area

65.682

Acid Dissociation Constant (pKa)

8.51

Base Dissociation Constant (pKb)

-8.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with 3584-1291 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3584-1291?
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What is the minimum amount of 3584-1291 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3584-1291
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3584-1291
  • 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 3584-1291 available by request