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SB656104

CAT: 0013-GTR19192708-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19192708-02Size:50 mg
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Description
SB656104 is a bioactive small molecule compound utilized in biochemical research. It serves as a valuable tool for in vitro and in vivo studies, particularly in the fields of cell signaling and enzymatic activity investigations.
CAS Number
446020-51-5
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
S (=O) (=O) (N1[C@@H] (CCN2CCC (OC3=CC=C (Cl) C=C3) CC2) CCC1) C=4C=C5C (=CC4) C=CN5
Molecular Formula
C25H30ClN3O3S
Molecular Weight
488.04
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

6-[(2R)-2-[2-[4-(4-chlorophenoxy)piperidin-1-yl]ethyl]pyrrolidin-1-yl]sulfonyl-1H-indole
CAS Number446020-51-5
PubChem CID10028436
IUPAC Name6-[(2R)-2-[2-[4-(4-chlorophenoxy)piperidin-1-yl]ethyl]pyrrolidin-1-yl]sulfonyl-1H-indole
Molecular FormulaC25H30ClN3O3S
Molecular Weight488.0
XLogP5
Topological Polar Surface Area74
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count33
Formal Charge0
Complexity732
SMILES
C1C[C@@H](N(C1)S(=O)(=O)C2=CC3=C(C=C2)C=CN3)CCN4CCC(CC4)OC5=CC=C(C=C5)Cl
InChI
InChI=1S/C25H30ClN3O3S/c26-20-4-6-22(7-5-20)32-23-11-16-28(17-12-23)15-10-21-2-1-14-29(21)33(30,31)24-8-3-19-9-13-27-25(19)18-24/h3-9,13,18,21,23,27H,1-2,10-12,14-17H2/t21-/m1/s1
InChIKey
QEGMGDYIJDZJCI-OAQYLSRUSA-N
Chemical Structure
2D Structure
2D structure of 6-[(2R)-2-[2-[4-(4-chlorophenoxy)piperidin-1-yl]ethyl]pyrrolidin-1-yl]sulfonyl-1H-indole
CAS: 446020-51-5
CID: 10028436
Formula: C25H30ClN3O3S
MW: 488.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight488.0
XLogP35
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass487.1696407
Monoisotopic Mass487.1696407
Topological Polar Surface Area74 Ų
Heavy Atom Count33
Formal Charge0
Complexity732
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T34546-01SB656104

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