3215-0658 Screening compound: (5Z)-5-[(3-bromophenyl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one

3215-0658 Screening compound: (5Z)-5-[(3-bromophenyl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
3215-0658 Screening compound: (5Z)-5-[(3-bromophenyl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3215-0658
(5Z)-5-[(3-bromophenyl)methylidene]-3-(propan-2-yl)-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

3215-0658

Molecular Formula

C13H12BrNOS2 (C13 H12 BrNOS2)

Compound Name

(5Z)-5-[(3-bromophenyl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-4-one

IUPAC name

(5Z)-5-[(3-bromophenyl)methylidene]-3-(propan-2-yl)-2-sulfanylidene-13-thiazolidin-4-one

SMILES

CC(C)N(C(/C(/S1)=C/c2cccc(Br)c2)=O)C1=S

InChI

InChI=1S/C13H12BrNOS2/c1-8(2)15-12(16)11(18-13(15)17)7-9-4-3-5-10(14)6-9/h3-8H,1-2H3

InChI Key

XULIWCNVQYYLBR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01458543

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.297

Distribution Coefficient, logD

4.297

Water Solubility, LogSw

-4.40

Polar Surface Area

16.435

Acid Dissociation Constant (pKa)

29.33

Base Dissociation Constant (pKb)

-0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with 3215-0658 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3215-0658?
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What is the minimum amount of 3215-0658 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3215-0658
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3215-0658
  • 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 3215-0658 available by request