Y070-1516 Screening compound: (5Z)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-[(2-fluorophenyl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one

Y070-1516 Screening compound: (5Z)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-[(2-fluorophenyl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one
Y070-1516 Screening compound: (5Z)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-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 Y070-1516
(5Z)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-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

Y070-1516

Molecular Formula

C19H12FN3O3S (C19 H12 FN3 O3 S)

Compound Name

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

IUPAC name

(5Z)-2-(23-dihydro-14-benzodioxin-2-yl)-5-[(2-fluorophenyl)methylidene]-5H6H-[124]triazolo[32-b][13]thiazol-6-one

SMILES

O=C1n2nc(C3Oc(cccc4)c4OC3)nc2S/C1=C\c(cccc1)c1F

InChI

InChI=1S/C19H12FN3O3S/c20-12-6-2-1-5-11(12)9-16-18(24)23-19(27-16)21-17(22-23)15-10-25-13-7-3-4-8-14(13)26-15/h1-9,15H,10H2/t15-/m0/s1

InChI Key

CGFPEBROLRSPEW-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD18075687

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.906

Distribution Coefficient, logD

3.906

Water Solubility, LogSw

-4.21

Polar Surface Area

52.633

Acid Dissociation Constant (pKa)

30.38

Base Dissociation Constant (pKb)

-3.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.50

Y070-1516 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with Y070-1516 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-1516?
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What is the minimum amount of Y070-1516 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-1516
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-1516
  • 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 Y070-1516 available by request