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ML-9 Free Base

CAT: 0013-GTR19204457-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19204457-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
ML-9 (free base) is a cell-permeable kinase inhibitor that selectively targets Akt, MLCK, and PKC, while also inhibiting STIM1 activity. It induces autophagy by promoting autophagosome formation and blocking their degradation, making it a useful research tool for studying cell signaling, calcium regulation, and autophagy in cellular models.
CAS Number
110448-31-2
Field of Research
Signal Transduction
Smiles
S (=O) (=O) (C=1C2=C (C (Cl) =CC=C2) C=CC1) N3CCCNCC3
Molecular Formula
C15H17ClN2O2S
Molecular Weight
324.83
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

ML-9 free base

1-[(5-chloro-1-naphthalenyl)sulfonyl]-1,4-diazepane is a member of naphthalenes and a sulfonic acid derivative.

CAS Number110448-31-2
PubChem CID4217
IUPAC Name1-(5-chloronaphthalen-1-yl)sulfonyl-1,4-diazepane
Molecular FormulaC15H17ClN2O2S
Molecular Weight324.8
XLogP2.6
Topological Polar Surface Area57.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity451
SMILES
C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CC=C3Cl
InChI
InChI=1S/C15H17ClN2O2S/c16-14-6-1-5-13-12(14)4-2-7-15(13)21(19,20)18-10-3-8-17-9-11-18/h1-2,4-7,17H,3,8-11H2
InChIKey
OZSMSRIUUDGTEP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of ML-9 free base
CAS: 110448-31-2
CID: 4217
Formula: C15H17ClN2O2S
MW: 324.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight324.8
XLogP32.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass324.0699267
Monoisotopic Mass324.0699267
Topological Polar Surface Area57.8 Ų
Heavy Atom Count21
Formal Charge0
Complexity451
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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