6187-1883 Screening compound: (5Z)-2-(2-bromophenyl)-5-[(5-methylfuran-2-yl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one

6187-1883 Screening compound: (5Z)-2-(2-bromophenyl)-5-[(5-methylfuran-2-yl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one
6187-1883 Screening compound: (5Z)-2-(2-bromophenyl)-5-[(5-methylfuran-2-yl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6187-1883
(5Z)-2-(2-bromophenyl)-5-[(5-methylfuran-2-yl)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

6187-1883

Molecular Formula

C16H10BrN3O2S (C16 H10 BrN3 O2 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1ccc(/C=C2\Sc3nc(-c(cccc4)c4Br)nn3C2=O)o1

InChI

InChI=1S/C16H10BrN3O2S/c1-9-6-7-10(22-9)8-13-15(21)20-16(23-13)18-14(19-20)11-4-2-3-5-12(11)17/h2-8H,1H3

InChI Key

BVUAQJINEZJNCE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04006771

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.019

Distribution Coefficient, logD

4.019

Water Solubility, LogSw

-4.38

Polar Surface Area

44.459

Acid Dissociation Constant (pKa)

33.22

Base Dissociation Constant (pKb)

-3.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

6187-1883 in Drug Discovery

Included in Screening Libraries

Human Transcription Factors Annotated Library (5098 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6187-1883 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 6187-1883 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6187-1883
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6187-1883
  • 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 6187-1883 available by request