G952-1358 Screening compound: 2-(2-ethylphenoxy)-N-[3-(2-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
Chemical Structure Depiction of ChemDiv screening compound G952-1358
2-(2-ethylphenoxy)-N-[3-(2-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
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
G952-1358
Molecular Formula
C20H19N5O3S (C20 H19 N5 O3 S)
Compound Name
2-(2-ethylphenoxy)-N-[3-(2-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
IUPAC name
2-(2-ethylphenoxy)-N-[3-(2-methoxyphenyl)-[124]triazolo[34-b][134]thiadiazol-6-yl]acetamide
SMILES
CCc(cccc1)c1OCC(Nc(s1)nn2c1nnc2-c(cccc1)c1OC)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
409.47
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
3.732
Distribution Coefficient, logD
3.731
Water Solubility, LogSw
-3.94
Polar Surface Area
72.128
Acid Dissociation Constant (pKa)
10.03
Base Dissociation Constant (pKb)
0.82
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.00
G952-1358 in Drug Discovery
Included in Screening Libraries
Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Female
- Hemic and lymphatic
- Metabolic
- Immune system
- Others
References: we are preparing a list of scientific research reports with G952-1358 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)