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Saviprazole

CAT: 0931-T28665-05Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T28665-05Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
121617-11-6
Target
Proton pump
Related Pathways
Membrane transporter/Ion channel
Purity
0.992
Bioactivity
Saviprazole (Hoe-731), a proton pump inhibitor, is used potentially for treatment of gastric ulcer.
Smiles
S(CC1=CC(OCC(C(C(F)(F)F)(F)F)(F)F)=CC=N1)(=O)C=2NC=3C(N2)=CSC3
Molecular Formula
C15H10F7N3O2S2
Molecular Weight
461.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Saviprazole

RN from Toxlit

CAS Number121617-11-6
PubChem CID65942
IUPAC Name2-[[4-(2,2,3,3,4,4,4-heptafluorobutoxy)-2-pyridinyl]methylsulfinyl]-1H-thieno[3,4-d]imidazole
Molecular FormulaC15H10F7N3O2S2
Molecular Weight461.4
XLogP3.6
Topological Polar Surface Area115
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count7
Heavy Atom Count29
Formal Charge0
Complexity611
SMILES
C1=CN=C(C=C1OCC(C(C(F)(F)F)(F)F)(F)F)CS(=O)C2=NC3=CSC=C3N2
InChI
InChI=1S/C15H10F7N3O2S2/c16-13(17,14(18,19)15(20,21)22)7-27-9-1-2-23-8(3-9)6-29(26)12-24-10-4-28-5-11(10)25-12/h1-5H,6-7H2,(H,24,25)
InChIKey
ARFGGIRJBPTBPP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Saviprazole
CAS: 121617-11-6
CID: 65942
Formula: C15H10F7N3O2S2
MW: 461.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight461.4
XLogP33.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count7
Exact Mass461.01026605
Monoisotopic Mass461.01026605
Topological Polar Surface Area115 Ų
Heavy Atom Count29
Formal Charge0
Complexity611
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5778342Saviprazole

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