Y070-3124 Screening compound: (5Z)-2-[(1E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-[(2-ethoxyphenyl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one

Y070-3124 Screening compound: (5Z)-2-[(1E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-[(2-ethoxyphenyl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one
Y070-3124 Screening compound: (5Z)-2-[(1E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-[(2-ethoxyphenyl)methylidene]-5H,6H-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-3124
(5Z)-2-[(1E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-[(2-ethoxyphenyl)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

Y070-3124

Molecular Formula

C23H21N3O4S (C23 H21 N3 O4 S)

Compound Name

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

IUPAC name

(5Z)-2-[(1E)-2-(34-dimethoxyphenyl)ethenyl]-5-[(2-ethoxyphenyl)methylidene]-5H6H-[124]triazolo[32-b][13]thiazol-6-one

SMILES

CCOc1c(/C=C2\Sc3nc(/C=C/c(cc4)cc(OC)c4OC)nn3C2=O)cccc1

InChI

InChI=1S/C23H21N3O4S/c1-4-30-17-8-6-5-7-16(17)14-20-22(27)26-23(31-20)24-21(25-26)12-10-15-9-11-18(28-2)19(13-15)29-3/h5-14H,4H2,1-3H3

InChI Key

XEFSNXIHVPHRIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07496789

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.557

Distribution Coefficient, logD

4.557

Water Solubility, LogSw

-4.47

Polar Surface Area

60.658

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

-3.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

Y070-3124 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Y070-3124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-3124?
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What is the minimum amount of Y070-3124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-3124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-3124
  • 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 Y070-3124 available by request