3324-0719 Screening compound: (5Z)-5-[(3-bromophenyl)methylidene]-3-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one

3324-0719 Screening compound: (5Z)-5-[(3-bromophenyl)methylidene]-3-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one
3324-0719 Screening compound: (5Z)-5-[(3-bromophenyl)methylidene]-3-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3324-0719
(5Z)-5-[(3-bromophenyl)methylidene]-3-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-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

3324-0719

Molecular Formula

C21H17BrN2O2S2 (C21 H17 BrN2 O2 S2)

Compound Name

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

IUPAC name

(5Z)-5-[(3-bromophenyl)methylidene]-3-[2-oxo-2-(1234-tetrahydroquinolin-1-yl)ethyl]-2-sulfanylidene-13-thiazolidin-4-one

SMILES

O=C(CN(C(/C(/S1)=C/c2cccc(Br)c2)=O)C1=S)N(CCC1)c2c1cccc2

InChI

InChI=1S/C21H17BrN2O2S2/c22-16-8-3-5-14(11-16)12-18-20(26)24(21(27)28-18)13-19(25)23-10-4-7-15-6-1-2-9-17(15)23/h1-3,5-6,8-9,11-12H,4,7,10,13H2

InChI Key

LTLSLYYNQXRVOE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02077735

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.649

Distribution Coefficient, logD

4.649

Water Solubility, LogSw

-4.63

Polar Surface Area

31.499

Acid Dissociation Constant (pKa)

24.05

Base Dissociation Constant (pKb)

-0.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

3324-0719 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3324-0719 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3324-0719?
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What is the minimum amount of 3324-0719 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3324-0719
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3324-0719
  • 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 3324-0719 available by request