5190-0536 Screening compound: (5Z)-2-(piperidin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-4,5-dihydro-1,3-thiazol-4-one

5190-0536 Screening compound: (5Z)-2-(piperidin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-4,5-dihydro-1,3-thiazol-4-one
5190-0536 Screening compound: (5Z)-2-(piperidin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-4,5-dihydro-1,3-thiazol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5190-0536
(5Z)-2-(piperidin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-4,5-dihydro-1,3-thiazol-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

5190-0536

Molecular Formula

C18H22N2O4S (C18 H22 N2 O4 S)

Compound Name

(5Z)-2-(piperidin-1-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-4,5-dihydro-1,3-thiazol-4-one

IUPAC name

(5Z)-2-(piperidin-1-yl)-5-[(345-trimethoxyphenyl)methylidene]-45-dihydro-13-thiazol-4-one

SMILES

COc1cc(/C=C2\SC(N3CCCCC3)=NC2=O)cc(OC)c1OC

InChI

InChI=1S/C18H22N2O4S/c1-22-13-9-12(10-14(23-2)16(13)24-3)11-15-17(21)19-18(25-15)20-7-5-4-6-8-20/h9-11H,4-8H2,1-3H3

InChI Key

CNILRYXLEWKUFC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05028698

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.946

Distribution Coefficient, logD

2.946

Water Solubility, LogSw

-3.23

Polar Surface Area

48.573

Acid Dissociation Constant (pKa)

28.03

Base Dissociation Constant (pKb)

1.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

5190-0536 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Antiviral Annotated Library (21441 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with 5190-0536 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5190-0536?
Check Price and Availability of 5190-0536, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 5190-0536 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5190-0536
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5190-0536
  • 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 5190-0536 available by request