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Silodosin N-Oxide

CAT: 0572-TRC-S465045-25MGSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-S465045-25MGSize:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2361272-05-9
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
C[C@H](Cc1cc2CC[N+]([O-])(CCCO)c2c(c1)C(=O)N)NCCOc3ccccc3OCC(F)(F)F
Molecular Formula
C25H32F3N3O5
Molecular Weight
511.53
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Silodosin N-Oxide
CAS Number2361272-05-9
PubChem CID169446394
IUPAC Name1-(3-hydroxypropyl)-1-oxido-5-[(2R)-2-[2-[2-(2,2,2-trifluoroethoxy)phenoxy]ethylamino]propyl]-2,3-dihydroindol-1-ium-7-carboxamide
Molecular FormulaC25H32F3N3O5
Molecular Weight511.5
XLogP2.9
Topological Polar Surface Area112
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count13
Heavy Atom Count36
Formal Charge0
Complexity700
SMILES
C[C@H](CC1=CC2=C(C(=C1)C(=O)N)[N+](CC2)(CCCO)[O-])NCCOC3=CC=CC=C3OCC(F)(F)F
InChI
InChI=1S/C25H32F3N3O5/c1-17(30-8-12-35-21-5-2-3-6-22(21)36-16-25(26,27)28)13-18-14-19-7-10-31(34,9-4-11-32)23(19)20(15-18)24(29)33/h2-3,5-6,14-15,17,30,32H,4,7-13,16H2,1H3,(H2,29,33)/t17-,31?/m1/s1
InChIKey
IZGKNEVGNJFXEF-WYXXSATOSA-N
Chemical Structure
2D Structure
2D structure of Silodosin N-Oxide
CAS: 2361272-05-9
CID: 169446394
Formula: C25H32F3N3O5
MW: 511.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight511.5
XLogP32.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count13
Exact Mass511.22940562
Monoisotopic Mass511.22940562
Topological Polar Surface Area112 Ų
Heavy Atom Count36
Formal Charge0
Complexity700
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
AR-S09241-01Silodosin N-Oxide
458466-01N-Carboxybenzyl Silodosin
RM-S120473-01N-Nitroso-Silodosin
AR-S10365-01N-Acetyl Silodosin
AR-S10364-01N-Nitroso Silodosin
CS-O-54793N-Nitroso-Silodosin-d4
CS-O-41374N-Nitroso Silodosin impurity
165475N-tert-Butyloxycarbonyl Silodosin
CS-O-41373N-Nitroso Benzoyl Silodosin impurity
CS-O-38502-10MGN-Nitroso-Silodosin (Mixture of isomer)

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