D221-0235 Screening compound: 2-[3-(TRIFLUOROMETHYL)-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZOL-6-YL]PYRIDINE

D221-0235 Screening compound: 2-[3-(TRIFLUOROMETHYL)-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZOL-6-YL]PYRIDINE
D221-0235 Screening compound: 2-[3-(TRIFLUOROMETHYL)-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZOL-6-YL]PYRIDINE alternative view

Chemical Structure Depiction of ChemDiv screening compound D221-0235
2-[3-(TRIFLUOROMETHYL)-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZOL-6-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

D221-0235

Molecular Formula

C9H4F3N5S (C9 H4 F3 N5 S)

Compound Name

2-[3-(TRIFLUOROMETHYL)-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZOL-6-YL]PYRIDINE

IUPAC name

2-[3-(trifluoromethyl)-[124]triazolo[34-b][134]thiadiazol-6-yl]pyridine

SMILES

FC(c1nnc2sc(-c3ncccc3)nn12)(F)F

InChI

InChI=1S/C9H4F3N5S/c10-9(11,12)7-14-15-8-17(7)16-6(18-8)5-3-1-2-4-13-5/h1-4H

InChI Key

YEORTIBZBZKBLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06591807

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

271.23

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.646

Distribution Coefficient, logD

1.646

Water Solubility, LogSw

-1.60

Polar Surface Area

43.041

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

D221-0235 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with D221-0235 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D221-0235?
Check Price and Availability of D221-0235, 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 D221-0235 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D221-0235
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D221-0235
  • 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 D221-0235 available by request