8020-6255 Screening compound: 3,5-dimethyl-4-{[3-(4-pyridyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}isoxazole

8020-6255 Screening compound: 3,5-dimethyl-4-{[3-(4-pyridyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}isoxazole
8020-6255 Screening compound: 3,5-dimethyl-4-{[3-(4-pyridyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}isoxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-6255
3,5-dimethyl-4-{[3-(4-pyridyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}isoxazole

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

8020-6255

Molecular Formula

C14H12N6OS (C14 H12 N6 OS)

Compound Name

3,5-dimethyl-4-{[3-(4-pyridyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}isoxazole

IUPAC name

n/a

SMILES

Cc1noc(C)c1Cc(s1)nn2c1nnc2-c1ccncc1

InChI

InChI=1S/C14H12N6OS/c1-8-11(9(2)21-19-8)7-12-18-20-13(16-17-14(20)22-12)10-3-5-15-6-4-10/h3-6H,7H2,1-2H3

InChI Key

DEGBMPQIGCLPRA-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.541

Distribution Coefficient, logD

1.541

Water Solubility, LogSw

-1.69

Polar Surface Area

65.683

Acid Dissociation Constant (pKa)

24.78

Base Dissociation Constant (pKb)

3.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

References: we are preparing a list of scientific research reports with 8020-6255 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-6255?
Check Price and Availability of 8020-6255, 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 8020-6255 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-6255
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-6255
  • 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 8020-6255 available by request