6187-1899 Screening compound: (5Z)-2-(2-bromophenyl)-5-[(2,5-dimethoxyphenyl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one

6187-1899 Screening compound: (5Z)-2-(2-bromophenyl)-5-[(2,5-dimethoxyphenyl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one
6187-1899 Screening compound: (5Z)-2-(2-bromophenyl)-5-[(2,5-dimethoxyphenyl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6187-1899
(5Z)-2-(2-bromophenyl)-5-[(2,5-dimethoxyphenyl)methylidene]-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

6187-1899

Molecular Formula

C19H14BrN3O3S (C19 H14 BrN3 O3 S)

Compound Name

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

IUPAC name

(5Z)-2-(2-bromophenyl)-5-[(25-dimethoxyphenyl)methylidene]-5H6H-[124]triazolo[32-b][13]thiazol-6-one

SMILES

COc(cc1)cc(/C=C2\Sc3nc(-c(cccc4)c4Br)nn3C2=O)c1OC

InChI

InChI=1S/C19H14BrN3O3S/c1-25-12-7-8-15(26-2)11(9-12)10-16-18(24)23-19(27-16)21-17(22-23)13-5-3-4-6-14(13)20/h3-10H,1-2H3

InChI Key

KLZJORCOLXIPPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04030674

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.31

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

4.413

Distribution Coefficient, logD

4.413

Water Solubility, LogSw

-4.57

Polar Surface Area

52.370

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with 6187-1899 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6187-1899?
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What is the minimum amount of 6187-1899 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6187-1899
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6187-1899
  • 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 6187-1899 available by request