1682-9859 Screening compound: (5Z)-3-(4-fluorophenyl)-5-[(4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

1682-9859 Screening compound: (5Z)-3-(4-fluorophenyl)-5-[(4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
1682-9859 Screening compound: (5Z)-3-(4-fluorophenyl)-5-[(4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-9859
(5Z)-3-(4-fluorophenyl)-5-[(4-methoxyphenyl)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

1682-9859

Molecular Formula

C17H12FNO2S2 (C17 H12 FNO2 S2)

Compound Name

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

IUPAC name

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

SMILES

COc1ccc(/C=C(/C(N2c(cc3)ccc3F)=O)\SC2=S)cc1

InChI

InChI=1S/C17H12FNO2S2/c1-21-14-8-2-11(3-9-14)10-15-16(20)19(17(22)23-15)13-6-4-12(18)5-7-13/h2-10H,1H3

InChI Key

RFYYOTQIOILUHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00711142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.957

Distribution Coefficient, logD

3.957

Water Solubility, LogSw

-4.22

Polar Surface Area

23.375

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-0.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

References: we are preparing a list of scientific research reports with 1682-9859 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-9859?
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What is the minimum amount of 1682-9859 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-9859
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-9859
  • 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 1682-9859 available by request