D064-0256 Screening compound: 4-[6-(2,3-dihydro-1,4-benzodioxin-6-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]pyridine

D064-0256 Screening compound: 4-[6-(2,3-dihydro-1,4-benzodioxin-6-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]pyridine
D064-0256 Screening compound: 4-[6-(2,3-dihydro-1,4-benzodioxin-6-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound D064-0256
4-[6-(2,3-dihydro-1,4-benzodioxin-6-yl)-[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

D064-0256

Molecular Formula

C16H11N5O2S (C16 H11 N5 O2 S)

Compound Name

4-[6-(2,3-dihydro-1,4-benzodioxin-6-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]pyridine

IUPAC name

4-[6-(23-dihydro-14-benzodioxin-6-yl)-[124]triazolo[34-b][134]thiadiazol-3-yl]pyridine

SMILES

C1Oc(ccc(-c(s2)nn3c2nnc3-c2ccncc2)c2)c2OC1

InChI

InChI=1S/C16H11N5O2S/c1-2-12-13(23-8-7-22-12)9-11(1)15-20-21-14(18-19-16(21)24-15)10-3-5-17-6-4-10/h1-6,9H,7-8H2

InChI Key

KHHFRRGSGJAHLT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05882951

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.503

Distribution Coefficient, logD

1.503

Water Solubility, LogSw

-1.83

Polar Surface Area

58.973

Acid Dissociation Constant (pKa)

30.26

Base Dissociation Constant (pKb)

3.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

D064-0256 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

Antifungal Library (16415 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Infections
  • Immune system
  • animal
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D064-0256 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D064-0256?
Check Price and Availability of D064-0256, 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 D064-0256 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D064-0256
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D064-0256
  • 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 D064-0256 available by request