3584-1188 Screening compound: (4E)-4-[(3-{2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy}phenyl)methylidene]-1-phenylpyrazolidine-3,5-dione

3584-1188 Screening compound: (4E)-4-[(3-{2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy}phenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
3584-1188 Screening compound: (4E)-4-[(3-{2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy}phenyl)methylidene]-1-phenylpyrazolidine-3,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3584-1188
(4E)-4-[(3-{2-[2-(3,4-dimethylphenoxy)ethoxy]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

3584-1188

Molecular Formula

C28H28N2O5 (C28 H28 N2 O5)

Compound Name

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

IUPAC name

(4E)-4-[(3-{2-[2-(34-dimethylphenoxy)ethoxy]ethoxy}phenyl)methylidene]-1-phenylpyrazolidine-35-dione

SMILES

Cc(cc1)c(C)cc1OCCOCCOc1cccc(/C=C(\C(NN2c3ccccc3)=O)/C2=O)c1

InChI

InChI=1S/C28H28N2O5/c1-20-11-12-25(17-21(20)2)35-16-14-33-13-15-34-24-10-6-7-22(18-24)19-26-27(31)29-30(28(26)32)23-8-4-3-5-9-23/h3-12,17-19H,13-16H2,1-2H3,(H,29,31)

InChI Key

GZXVFUJUWBRAIP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02121346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.54

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

4.640

Distribution Coefficient, logD

4.577

Water Solubility, LogSw

-4.46

Polar Surface Area

65.595

Acid Dissociation Constant (pKa)

8.21

Base Dissociation Constant (pKb)

-7.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

References: we are preparing a list of scientific research reports with 3584-1188 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3584-1188?
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What is the minimum amount of 3584-1188 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3584-1188
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3584-1188
  • 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 3584-1188 available by request