3584-1071 Screening compound: (5E)-5-({5-bromo-2-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

3584-1071 Screening compound: (5E)-5-({5-bromo-2-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
3584-1071 Screening compound: (5E)-5-({5-bromo-2-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3584-1071
(5E)-5-({5-bromo-2-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

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

3584-1071

Molecular Formula

C20H18BrNO3S2 (C20 H18 BrNO3 S2)

Compound Name

(5E)-5-({5-bromo-2-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

IUPAC name

(5E)-5-({5-bromo-2-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-3-methyl-2-sulfanylidene-13-thiazolidin-4-one

SMILES

Cc(cc1)ccc1OCCOc(cc1)c(/C=C(\C(N2C)=O)/SC2=S)cc1Br

InChI

InChI=1S/C20H18BrNO3S2/c1-13-3-6-16(7-4-13)24-9-10-25-17-8-5-15(21)11-14(17)12-18-19(23)22(2)20(26)27-18/h3-8,11-12H,9-10H2,1-2H3

InChI Key

CWBMSWRUBQUYKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02121234

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.462

Distribution Coefficient, logD

5.462

Water Solubility, LogSw

-5.39

Polar Surface Area

31.130

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-1.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 3584-1071 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3584-1071?
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What is the minimum amount of 3584-1071 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3584-1071
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3584-1071
  • 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 3584-1071 available by request