D064-0315 Screening compound: 3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-(2-pyrazinyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

D064-0315 Screening compound: 3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-(2-pyrazinyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
D064-0315 Screening compound: 3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-(2-pyrazinyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D064-0315
3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-(2-pyrazinyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

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

D064-0315

Molecular Formula

C15H10N6O2S (C15 H10 N6 O2 S)

Compound Name

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

IUPAC name

n/a

SMILES

C1Oc(cccc2)c2OC1c1nnc2sc(-c3nccnc3)nn12

InChI

InChI=1S/C15H10N6O2S/c1-2-4-11-10(3-1)22-8-12(23-11)13-18-19-15-21(13)20-14(24-15)9-7-16-5-6-17-9/h1-7,12H,8H2/t12-/m0/s1

InChI Key

LGNWONICJIZQIN-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD05882947

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.582

Distribution Coefficient, logD

1.582

Water Solubility, LogSw

-1.55

Polar Surface Area

67.724

Acid Dissociation Constant (pKa)

24.59

Base Dissociation Constant (pKb)

2.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.30

D064-0315 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with D064-0315 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D064-0315?
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What is the minimum amount of D064-0315 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D064-0315
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D064-0315
  • 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 D064-0315 available by request