3241-0137 Screening compound: (5Z)-5-{[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one

3241-0137 Screening compound: (5Z)-5-{[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
3241-0137 Screening compound: (5Z)-5-{[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3241-0137
(5Z)-5-{[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}-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

3241-0137

Molecular Formula

C19H16ClNO4S2 (C19 H16 ClNO4 S2)

Compound Name

(5Z)-5-{[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one

IUPAC name

(5Z)-5-{[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}-2-sulfanylidene-13-thiazolidin-4-one

SMILES

COc1cc(/C=C(/C(N2)=O)\SC2=S)cc(Cl)c1OCCOc1ccccc1

InChI

InChI=1S/C19H16ClNO4S2/c1-23-15-10-12(11-16-18(22)21-19(26)27-16)9-14(20)17(15)25-8-7-24-13-5-3-2-4-6-13/h2-6,9-11H,7-8H2,1H3,(H,21,22,26)

InChI Key

OCFCKKLQHZOOKQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02109099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.93

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.666

Distribution Coefficient, logD

2.315

Water Solubility, LogSw

-4.09

Polar Surface Area

47.268

Acid Dissociation Constant (pKa)

6.07

Base Dissociation Constant (pKb)

-0.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

3241-0137 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3241-0137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3241-0137?
Check Price and Availability of 3241-0137, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3241-0137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3241-0137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3241-0137
  • 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 3241-0137 available by request