3215-0601 Screening compound: (5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

3215-0601 Screening compound: (5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
3215-0601 Screening compound: (5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3215-0601
(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-(2-phenylethyl)-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

3215-0601

Molecular Formula

C19H17NO3S2 (C19 H17 NO3 S2)

Compound Name

(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

IUPAC name

(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-3-(2-phenylethyl)-2-sulfanylidene-13-thiazolidin-4-one

SMILES

COc(cc(/C=C(/C(N1CCc2ccccc2)=O)\SC1=S)cc1)c1O

InChI

InChI=1S/C19H17NO3S2/c1-23-16-11-14(7-8-15(16)21)12-17-18(22)20(19(24)25-17)10-9-13-5-3-2-4-6-13/h2-8,11-12,21H,9-10H2,1H3

InChI Key

YYYKIHLFWDLBMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01056519

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.690

Distribution Coefficient, logD

3.685

Water Solubility, LogSw

-3.79

Polar Surface Area

40.599

Acid Dissociation Constant (pKa)

9.35

Base Dissociation Constant (pKb)

-1.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

3215-0601 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 3215-0601 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3215-0601?
Check Price and Availability of 3215-0601, 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 3215-0601 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3215-0601
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3215-0601
  • 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 3215-0601 available by request