C639-0290 Screening compound: (5Z)-5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-3-(3-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one

C639-0290 Screening compound: (5Z)-5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-3-(3-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
C639-0290 Screening compound: (5Z)-5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-3-(3-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C639-0290
(5Z)-5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-3-(3-fluorophenyl)-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

C639-0290

Molecular Formula

C21H13ClFNO2S3 (C21 H13 ClFNO2 S3)

Compound Name

(5Z)-5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-3-(3-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one

IUPAC name

(5Z)-5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-3-(3-fluorophenyl)-2-sulfanylidene-13-thiazolidin-4-one

SMILES

O=C(/C(/SC1=S)=C/c(o2)ccc2SCc(cc2)ccc2Cl)N1c1cc(F)ccc1

InChI

InChI=1S/C21H13ClFNO2S3/c22-14-6-4-13(5-7-14)12-28-19-9-8-17(26-19)11-18-20(25)24(21(27)29-18)16-3-1-2-15(23)10-16/h1-11H,12H2

InChI Key

LIFVOHVYSGRRSF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14778627

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.99

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.098

Distribution Coefficient, logD

6.098

Water Solubility, LogSw

-6.37

Polar Surface Area

23.621

Acid Dissociation Constant (pKa)

28.02

Base Dissociation Constant (pKb)

-0.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

References: we are preparing a list of scientific research reports with C639-0290 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C639-0290?
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What is the minimum amount of C639-0290 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C639-0290
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C639-0290
  • 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 C639-0290 available by request