4719-0029 Screening compound: (5Z)-5-[(2,4-dimethoxyphenyl)methylidene]-2-(morpholin-4-yl)-4,5-dihydro-1,3-thiazol-4-one

4719-0029 Screening compound: (5Z)-5-[(2,4-dimethoxyphenyl)methylidene]-2-(morpholin-4-yl)-4,5-dihydro-1,3-thiazol-4-one
4719-0029 Screening compound: (5Z)-5-[(2,4-dimethoxyphenyl)methylidene]-2-(morpholin-4-yl)-4,5-dihydro-1,3-thiazol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4719-0029
(5Z)-5-[(2,4-dimethoxyphenyl)methylidene]-2-(morpholin-4-yl)-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

4719-0029

Molecular Formula

C16H18N2O4S (C16 H18 N2 O4 S)

Compound Name

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

IUPAC name

(5Z)-5-[(24-dimethoxyphenyl)methylidene]-2-(morpholin-4-yl)-45-dihydro-13-thiazol-4-one

SMILES

COc1cc(OC)c(/C=C2\SC(N3CCOCC3)=NC2=O)cc1

InChI

InChI=1S/C16H18N2O4S/c1-20-12-4-3-11(13(10-12)21-2)9-14-15(19)17-16(23-14)18-5-7-22-8-6-18/h3-4,9-10H,5-8H2,1-2H3

InChI Key

KAQRNBFEIXEWRO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00845321

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.226

Distribution Coefficient, logD

2.226

Water Solubility, LogSw

-2.79

Polar Surface Area

48.678

Acid Dissociation Constant (pKa)

29.10

Base Dissociation Constant (pKb)

1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

4719-0029 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 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 4719-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4719-0029?
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What is the minimum amount of 4719-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4719-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4719-0029
  • 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 4719-0029 available by request