8019-6163 Screening compound: 3-{5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-3-yl}pyridine
Chemical Structure Depiction of ChemDiv screening compound 8019-6163
3-{5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-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
8019-6163
Molecular Formula
C9H8N4S (C9 H8 N4 S)
Compound Name
3-{5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazol-3-yl}pyridine
IUPAC name
3-{5H6H-[124]triazolo[34-b][13]thiazol-3-yl}pyridine
SMILES
C(CS1)n2c1nnc2-c1cnccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
204.26
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
1.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
0.673
Distribution Coefficient, logD
0.653
Water Solubility, LogSw
-0.79
Polar Surface Area
33.708
Acid Dissociation Constant (pKa)
19.03
Base Dissociation Constant (pKb)
6.07
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
22.20
8019-6163 in Drug Discovery
Included in Screening Libraries
Antiparasite Library (23996 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
CNS BBB Library (22607 compounds)
Fragments Library (11262 compounds)
Epitranscriptome Focused Small Molecule Library (20952 compounds)
Ion Channels Focused Library (26372 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Nervous system
- Nervous system
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Nervous system
- Cardiovascular
- Agro
- Fragments
- Epigenetic
- Ion Channels
References: we are preparing a list of scientific research reports with 8019-6163 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)