6187-1876 Screening compound: (5Z)-5-[(2,3-dimethoxyphenyl)methylidene]-2-(3-methylphenyl)-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one

6187-1876 Screening compound: (5Z)-5-[(2,3-dimethoxyphenyl)methylidene]-2-(3-methylphenyl)-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one
6187-1876 Screening compound: (5Z)-5-[(2,3-dimethoxyphenyl)methylidene]-2-(3-methylphenyl)-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6187-1876
(5Z)-5-[(2,3-dimethoxyphenyl)methylidene]-2-(3-methylphenyl)-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-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

6187-1876

Molecular Formula

C20H17N3O3S (C20 H17 N3 O3 S)

Compound Name

(5Z)-5-[(2,3-dimethoxyphenyl)methylidene]-2-(3-methylphenyl)-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one

IUPAC name

(5Z)-5-[(23-dimethoxyphenyl)methylidene]-2-(3-methylphenyl)-5H6H-[124]triazolo[32-b][13]thiazol-6-one

SMILES

Cc1cccc(-c2nn(C(/C(/S3)=C/c(cccc4OC)c4OC)=O)c3n2)c1

InChI

InChI=1S/C20H17N3O3S/c1-12-6-4-8-14(10-12)18-21-20-23(22-18)19(24)16(27-20)11-13-7-5-9-15(25-2)17(13)26-3/h4-11H,1-3H3

InChI Key

DAJXGSCOPOYZPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04011771

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.44

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

4.389

Distribution Coefficient, logD

4.389

Water Solubility, LogSw

-4.54

Polar Surface Area

52.543

Acid Dissociation Constant (pKa)

27.89

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with 6187-1876 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6187-1876?
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What is the minimum amount of 6187-1876 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6187-1876
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6187-1876
  • 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 6187-1876 available by request