3584-1236 Screening compound: (4E)-4-({3-methoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione

3584-1236 Screening compound: (4E)-4-({3-methoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione
3584-1236 Screening compound: (4E)-4-({3-methoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3584-1236
(4E)-4-({3-methoxy-4-[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

3584-1236

Molecular Formula

C27H26N2O6 (C27 H26 N2 O6)

Compound Name

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

IUPAC name

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

SMILES

COc(cc(/C=C(\C(NN1c2ccccc2)=O)/C1=O)cc1)c1OCCOCCOc1ccccc1

InChI

InChI=1S/C27H26N2O6/c1-32-25-19-20(18-23-26(30)28-29(27(23)31)21-8-4-2-5-9-21)12-13-24(25)35-17-15-33-14-16-34-22-10-6-3-7-11-22/h2-13,18-19H,14-17H2,1H3,(H,28,30)

InChI Key

IHPFCJFZGQJUBT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02121394

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.262

Distribution Coefficient, logD

3.199

Water Solubility, LogSw

-3.47

Polar Surface Area

73.312

Acid Dissociation Constant (pKa)

8.21

Base Dissociation Constant (pKb)

-7.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

References: we are preparing a list of scientific research reports with 3584-1236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3584-1236?
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What is the minimum amount of 3584-1236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3584-1236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3584-1236
  • 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 3584-1236 available by request