0930-0130 Screening compound: (5Z)-5-[(2,4-diethoxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one

0930-0130 Screening compound: (5Z)-5-[(2,4-diethoxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
0930-0130 Screening compound: (5Z)-5-[(2,4-diethoxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 0930-0130
(5Z)-5-[(2,4-diethoxyphenyl)methylidene]-3-phenyl-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

0930-0130

Molecular Formula

C20H19NO3S2 (C20 H19 NO3 S2)

Compound Name

(5Z)-5-[(2,4-diethoxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one

IUPAC name

(5Z)-5-[(24-diethoxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-13-thiazolidin-4-one

SMILES

CCOc1cc(OCC)c(/C=C(/C(N2c3ccccc3)=O)\SC2=S)cc1

InChI

InChI=1S/C20H19NO3S2/c1-3-23-16-11-10-14(17(13-16)24-4-2)12-18-19(22)21(20(25)26-18)15-8-6-5-7-9-15/h5-13H,3-4H2,1-2H3

InChI Key

IPLHTTYLMFDKBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00993257

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.51

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

4.747

Distribution Coefficient, logD

4.747

Water Solubility, LogSw

-4.46

Polar Surface Area

30.165

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

-0.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

0930-0130 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0930-0130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0930-0130?
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What is the minimum amount of 0930-0130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0930-0130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0930-0130
  • 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 0930-0130 available by request