D064-0250 Screening compound: 4-{6-[(1E)-2-(2-methoxyphenyl)ethenyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}pyridine

D064-0250 Screening compound: 4-{6-[(1E)-2-(2-methoxyphenyl)ethenyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}pyridine
D064-0250 Screening compound: 4-{6-[(1E)-2-(2-methoxyphenyl)ethenyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound D064-0250
4-{6-[(1E)-2-(2-methoxyphenyl)ethenyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}pyridine

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

D064-0250

Molecular Formula

C17H13N5OS (C17 H13 N5 OS)

Compound Name

4-{6-[(1E)-2-(2-methoxyphenyl)ethenyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}pyridine

IUPAC name

4-{6-[(1E)-2-(2-methoxyphenyl)ethenyl]-[124]triazolo[34-b][134]thiadiazol-3-yl}pyridine

SMILES

COc1c(/C=C/c(s2)nn3c2nnc3-c2ccncc2)cccc1

InChI

InChI=1S/C17H13N5OS/c1-23-14-5-3-2-4-12(14)6-7-15-21-22-16(19-20-17(22)24-15)13-8-10-18-11-9-13/h2-11H,1H3

InChI Key

RWWBNIFRNNVIDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05882964

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.866

Distribution Coefficient, logD

2.866

Water Solubility, LogSw

-2.97

Polar Surface Area

51.275

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

3.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

D064-0250 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Proline Kinase Library (2105 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D064-0250 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D064-0250?
Check Price and Availability of D064-0250, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D064-0250 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D064-0250
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D064-0250
  • 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 D064-0250 available by request