Metabolite 6-Hydroxy rizatriptan sulfate
- Name
- 6-Hydroxy rizatriptan sulfate
- Description
- Not Available
- Structure
Structure for 6-Hydroxy rizatriptan sulfate
- Synonyms
- 6-Hydroxy-rizatriptan sulfate / 6-Hydroxyrizatriptan sulfate
- UNII
- 2GYM5ZWF3K
- CAS number
- 260435-44-7
- Weight
- Average: 365.41
Monoisotopic: 365.115775286 - Chemical Formula
- C15H19N5O4S
- InChI Key
- RSJDJCJGEBRSQZ-UHFFFAOYSA-N
- InChI
- InChI=1S/C15H19N5O4S/c1-19(2)4-3-11-7-17-14-6-15(24-25(21,22)23)12(5-13(11)14)8-20-10-16-9-18-20/h5-7,9-10,17H,3-4,8H2,1-2H3,(H,21,22,23)
- IUPAC Name
- {3-[2-(dimethylamino)ethyl]-5-[(1H-1,2,4-triazol-1-yl)methyl]-1H-indol-6-yl}oxidanesulfonic acid
- SMILES
- CN(C)CCC1=CNC2=C1C=C(CN1C=NC=N1)C(OS(O)(=O)=O)=C2
- Reactions
- Spectra
- Not Available
- Chromatographic Properties
Collision Cross Sections (CCS)
Not Available- External Links
- ChemSpider
- 8151676
- Predicted Properties
Property Value Source logP -0.49 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 6 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 113.34 Å2 Chemaxon Rotatable Bond Count 7 Chemaxon Refractivity 105.1 m3·mol-1 Chemaxon Polarizability 36.38 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon