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ML-SI3

CAT: 0013-GTR19165693-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19165693-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
ML-SI3 is a selective small-molecule inhibitor of TRPML1, TRPML2, and TRPML3 calcium channels. It serves as a valuable research tool for investigating the role of these channels in lysosomal function, with applications in studies of neurodegenerative and cardiovascular disease models both in vitro and in vivo.
CAS Number
891016-02-7
Product Name Alternative
ML-SI3, GlucagonReceptor, Glucagon Receptor, GLP-1, CCG143140, CCG-143140, CCG 143140, TRPVChannel, TRPChannel, TRPV Channel, TRP Channel
Field of Research
Infectious Disease & Virology, Pharmacology & Drug Discovery
Purity
99.75% (May vary between batches)
Solubility
DMSO:65 mg/mL (151.31 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:1 mg/mL (2.33 mM)
Smiles
COc1ccccc1N1CCN (CC1) C1CCCCC1NS (=O) (=O) c1ccccc1
Molecular Formula
C23H31N3O3S
Molecular Weight
429.58
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-{2-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl}benzenesulfonamide
CAS Number891016-02-7
PubChem CID23604942
IUPAC NameN-[2-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]benzenesulfonamide
Molecular FormulaC23H31N3O3S
Molecular Weight429.6
XLogP3.8
Topological Polar Surface Area70.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count30
Formal Charge0
Complexity624
SMILES
COC1=CC=CC=C1N2CCN(CC2)C3CCCCC3NS(=O)(=O)C4=CC=CC=C4
InChI
InChI=1S/C23H31N3O3S/c1-29-23-14-8-7-13-22(23)26-17-15-25(16-18-26)21-12-6-5-11-20(21)24-30(27,28)19-9-3-2-4-10-19/h2-4,7-10,13-14,20-21,24H,5-6,11-12,15-18H2,1H3
InChIKey
OVTXOMMQHRIKGL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-{2-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl}benzenesulfonamide
CAS: 891016-02-7
CID: 23604942
Formula: C23H31N3O3S
MW: 429.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight429.6
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass429.20861303
Monoisotopic Mass429.20861303
Topological Polar Surface Area70.3 Ų
Heavy Atom Count30
Formal Charge0
Complexity624
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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