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P053

CAT: 0931-T12342-03Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T12342-03Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2748196-63-4
Target
Others, Acyltransferase
Related Pathways
Metabolism, Others
Bioactivity
P053 is a potent, non-competitive, and selective ceramide synthase 1 (CerS1) inhibitor with an IC50 of 0.5 μM. It acts as an endogenous inhibitor of mitochondrial fatty acid oxidation in muscle and regulates whole-body adiposity[1].
Smiles
C[C@@](N)(CO)CCc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1
Molecular Formula
C18H21Cl2NO2
Molecular Weight
354.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(S)-2-amino-4-(4-((3,4-dichlorobenzyl)oxy)phenyl)-2-methylbutan-1-ol
CAS Number2748196-63-4
PubChem CID137700518
IUPAC Name(2S)-2-amino-4-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-2-methylbutan-1-ol
Molecular FormulaC18H21Cl2NO2
Molecular Weight354.3
XLogP3.9
Topological Polar Surface Area55.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count23
Formal Charge0
Complexity350
SMILES
C[C@](CCC1=CC=C(C=C1)OCC2=CC(=C(C=C2)Cl)Cl)(CO)N
InChI
InChI=1S/C18H21Cl2NO2/c1-18(21,12-22)9-8-13-2-5-15(6-3-13)23-11-14-4-7-16(19)17(20)10-14/h2-7,10,22H,8-9,11-12,21H2,1H3/t18-/m0/s1
InChIKey
ZQQHXJCIFGMUPY-SFHVURJKSA-N
Chemical Structure
2D Structure
2D structure of (S)-2-amino-4-(4-((3,4-dichlorobenzyl)oxy)phenyl)-2-methylbutan-1-ol
CAS: 2748196-63-4
CID: 137700518
Formula: C18H21Cl2NO2
MW: 354.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight354.3
XLogP33.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass353.0949343
Monoisotopic Mass353.0949343
Topological Polar Surface Area55.5 Ų
Heavy Atom Count23
Formal Charge0
Complexity350
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
BA7110-5.1P053
A24578-10P053 10mg
A24578-100P053 100mg
A24578-50P053 50mg
A24578-5P053 5mg
239578P/P053/NL419/PP-148X210-1 Prohibited Activity Signs (No Adhesive)
239491P/P053/NT/PP-DIA150-1 Prohibited Activity Signs (No Adhesive)
239581P/P053/NL419/ALU-150X50-1 Prohibited Activity Signs (No Adhesive)
239584P/P053/NL419/ALU-148X210-1 Prohibited Activity Signs (No Adhesive)
239495P/P053/NT/ALU-DIA100-1 Prohibited Activity Signs (No Adhesive)

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