English name: GW-501516
CAS number: 317318-70-0
Molecular formula: C21H18F3NO3S2
Molecular weight: 453.5
EINECS number: 1592732-453-0
MDL No. : MFCD09033000
Stats
Melting point 134-136°C
Boiling point 584.5±60.0 °C(Predicted)
Density 1.42± 0.1g /cm3(Predicted)
Storage condition -20°C
Solubility DMSO: soluble20mg/mL, clear
Morphology powder
Acidity coefficient (pKa)3.17±0.10(Predicted)
The color is white to beige
BRN18515150
Light Sensitive to stability
InChIInChI = 1 s/C21H18F3NO3S2 / c1-12-9-16 (27), 7-8-17 (12), 7-8-17 (26) the 29-11-18-13 (2) 25-20 (30-18) the 14-3-5-15 (6-4-14) 21 (22, 23) / 24 h 3-9 H, 10-11 h2, 1-2 h3, (H, 26, 27)
InChIKeyYDBLKRPLXZNVNB-UHFFFAOYSA-N
SMILESC(O)(=O)COC1=CC=C(SCC2SC(C3=CC=C(C(F)(F)F)C=C3)=NC=2C)C=C1C
Safety information
GHS hazard pictograms GHS Hazard pictograms
GHS07
Warning word
Hazard Description H315-H319-H335
Precautions P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P321-P362+P364-P332+P313-P337+P313-P403+P233-P405-P501
WGK Germany3
RTECS number AI9105500


