4670-0405 Screening compound: (6Z)-3-(2-chlorophenyl)-6-[(5-methylfuran-2-yl)methylidene]-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one

4670-0405 Screening compound: (6Z)-3-(2-chlorophenyl)-6-[(5-methylfuran-2-yl)methylidene]-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one
4670-0405 Screening compound: (6Z)-3-(2-chlorophenyl)-6-[(5-methylfuran-2-yl)methylidene]-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4670-0405
(6Z)-3-(2-chlorophenyl)-6-[(5-methylfuran-2-yl)methylidene]-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-5-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

4670-0405

Molecular Formula

C16H10ClN3O2S (C16 H10 ClN3 O2 S)

Compound Name

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

IUPAC name

(6Z)-3-(2-chlorophenyl)-6-[(5-methylfuran-2-yl)methylidene]-5H6H-[124]triazolo[34-b][13]thiazol-5-one

SMILES

Cc1ccc(/C=C2\Sc3nnc(-c(cccc4)c4Cl)n3C2=O)o1

InChI

InChI=1S/C16H10ClN3O2S/c1-9-6-7-10(22-9)8-13-15(21)20-14(18-19-16(20)23-13)11-4-2-3-5-12(11)17/h2-8H,1H3

InChI Key

ZNWOMYOAOGOZGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02924062

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.79

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

3.550

Distribution Coefficient, logD

3.550

Water Solubility, LogSw

-3.90

Polar Surface Area

45.207

Acid Dissociation Constant (pKa)

33.22

Base Dissociation Constant (pKb)

-2.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

4670-0405 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4670-0405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4670-0405?
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What is the minimum amount of 4670-0405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4670-0405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4670-0405
  • 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 4670-0405 available by request