4341-1161 Screening compound: (5Z)-2-(4-ethoxyphenyl)-5-[(2-fluorophenyl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one

4341-1161 Screening compound: (5Z)-2-(4-ethoxyphenyl)-5-[(2-fluorophenyl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one
4341-1161 Screening compound: (5Z)-2-(4-ethoxyphenyl)-5-[(2-fluorophenyl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4341-1161
(5Z)-2-(4-ethoxyphenyl)-5-[(2-fluorophenyl)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

4341-1161

Molecular Formula

C19H14FN3O2S (C19 H14 FN3 O2 S)

Compound Name

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

IUPAC name

(5Z)-2-(4-ethoxyphenyl)-5-[(2-fluorophenyl)methylidene]-5H6H-[124]triazolo[32-b][13]thiazol-6-one

SMILES

CCOc(cc1)ccc1-c1nn(C(/C(/S2)=C/c(cccc3)c3F)=O)c2n1

InChI

InChI=1S/C19H14FN3O2S/c1-2-25-14-9-7-12(8-10-14)17-21-19-23(22-17)18(24)16(26-19)11-13-5-3-4-6-15(13)20/h3-11H,2H2,1H3

InChI Key

UCBRDPONHZFNGV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03009110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.656

Distribution Coefficient, logD

4.656

Water Solubility, LogSw

-4.40

Polar Surface Area

44.320

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

-3.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with 4341-1161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4341-1161?
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What is the minimum amount of 4341-1161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4341-1161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4341-1161
  • 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 4341-1161 available by request