CAS No. 544417-40-5

Capadenoson Pricing >

 

Product Information

Chemical Formula: C25H18ClN5O2S2
Molecular Weight:520.03
Synonyms:Capadenoson; 2-Amino-6-[[[2-(4-Chlorophenyl)-4-Thiazolyl]Methyl]Thio]-4-[4-(2-Hydroxyethoxy)Phenyl]-3,5-Pyridinedicarbonitrile; Bay 68-4986; Capadenoson, Bay 68-4986
MDL No.:MFCD09954113
EINECS / EC No.:N/A
Pubchem CID:9936489
IUPAC Name:2-amino-6-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methylsulfanyl]-4-[4-(2-hydroxyethoxy)phenyl]pyridine-3,5-dicarbonitrile
Standard InchI:InChI=1S/C25H18ClN5O2S2/c26-17-5-1-16(2-6-17)24-30-18(13-34-24)14-35-25-21(12-28)22(20(11-27)23(29)31-25)15-3-7-19(8-4-15)33-10-9-32/h1-8,13,32H,9-10,14H2,(H2,29,31)
InchI Key:CITWCLNVRIKQAF-UHFFFAOYSA-N
SMILES:C1=CC(=CC=C1C2=C(C(=NC(=C2C#N)SCC3=CSC(=N3)C4=CC=C(C=C4)Cl)N)C#N)OCCO
Appearance:-
Melting Point:N/A
Boiling Point:787.9±70.0 °C at 760 mmHg
Density (Theoretical):1.51

Safety Information

Signal Word: Warning
Hazard Statements:H302
Precautionary Statements:P280-P305 P351 P338
Transportation Information:N/A
GHS Pictograms:Exclamation Mark - GHS07