D221-0190 Screening compound: 6-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of ChemDiv screening compound D221-0190
6-(furan-2-yl)-[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
D221-0190
Molecular Formula
C7H4N4OS (C7 H4 N4 OS)
Compound Name
6-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
IUPAC name
6-(furan-2-yl)-[124]triazolo[34-b][134]thiadiazole
SMILES
c1coc(-c(s2)nn3c2nnc3)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
192.2
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
1.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
0.731
Distribution Coefficient, logD
0.731
Water Solubility, LogSw
-1.45
Polar Surface Area
43.223
Acid Dissociation Constant (pKa)
14.00
Base Dissociation Constant (pKb)
-0.42
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
0.00
D221-0190 in Drug Discovery
Included in Screening Libraries
Chelators targeting matrix metalloproteinases library (8930 compounds)
Fragments Library (11262 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Cardiovascular
- Proteases
- Fragments
References: we are preparing a list of scientific research reports with D221-0190 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)