CAS 1218778-77-8: [1,1′-Biphenyl]-3-carboxamide, N-[6-[(2R,6S)-2,6-dimethyl-4-morpholinyl]-3-pyridinyl]-2-methyl-4′-(trifluoromethoxy)-, rel-, phosphate (1:2)

Description: [1,1′-Biphenyl]-3-carboxamide, N-[6-[(2R,6S)-2,6-dimethyl-4-morpholinyl]-3-pyridinyl]-2-methyl-4′-(trifluoromethoxy)-, rel-, phosphate (1:2) is a complex organic compound characterized by its biphenyl structure and the presence of multiple functional groups, including a carboxamide and a phosphate moiety. The compound features a trifluoromethoxy group, which enhances its lipophilicity and may influence its biological activity. The morpholine and pyridine rings contribute to its potential pharmacological properties, possibly affecting receptor interactions or enzyme inhibition. The stereochemistry indicated by the (2R,6S) configuration suggests specific spatial arrangements that can significantly impact the compound's reactivity and biological efficacy. This substance may be of interest in medicinal chemistry, particularly in the development of pharmaceuticals targeting specific biological pathways. Its CAS number, 1218778-77-8, allows for precise identification in chemical databases, facilitating research and development efforts. Overall, the compound's unique structural features suggest potential applications in various fields, including drug discovery and development.

Formula: C₂₆H₂₆F₃N₃O₃·2H₃O₄P

InChI: InChI=1/C26H26F3N3O3.H3O4P/c1-16-14-32(15-17(2)34-16)24-12-9-20(13-30-24)31-25(33)23-6-4-5-22(18(23)3)19-7-10-21(11-8-19)35-26(27,28)29;1-5(2,3)4/h4-13,16-17H,14-15H2,1-3H3,(H,31,33);(H3,1,2,3,4)/t16-,17+;

InChI key: InChIKey=RMTWWCZVPBZSMR-OKZTUQRJNA-N

SMILES: O=C(NC1=CN=C(C=C1)N2CC(OC(C)C2)C)C3=CC=CC(C4=CC=C(OC(F)(F)F)C=C4)=C3C.O=P(O)(O)O

Synonyms:

• Sonidegib phosphate
• [1,1′-Biphenyl]-3-carboxamide, N-[6-[(2R,6S)-2,6-dimethyl-4-morpholinyl]-3-pyridinyl]-2-methyl-4′-(trifluoromethoxy)-, rel-, phosphate (1:2)
• LDE 225 phosphate
• Odomzo

Sonidegib diphosphate

CAS: 1218778-77-8

Sonidegib diphosphate (LDE225 diphosphate) is a selective antagonist of Smo that inhibits murine Smo and …

• Formula: C₂₆H₃₂F₃N₃O₁₁P₂
• Purity: 99.48%
• Color and Shape: Solid
• Molecular weight: 681.49

Erismodegib Diphosphate

CAS: 1218778-77-8

• Formula: C₂₆H₂₆F₃N₃O₃·2H₃O₄P
• Molecular weight: 485.51 2*97.99

Sonidegib diphosphate

CAS: 1218778-77-8

• Purity: ≥98%
• Molecular weight: 681.49g/mol

LDE-225 Diphosphate

CAS: 1218778-77-8

• Formula: C₂₆H₃₂F₃N₃O₁₁P₂
• Purity: %
• Color and Shape: Solid
• Molecular weight: 681.4885

Sonidegib phosphate

CAS: 1218778-77-8

Sonidegib phosphate is an inhibitor of receptor tyrosine kinase, which is a protein that stimulates …

• Formula: C₂₆H₂₆F₃N₃O₃•(H₃PO₄)₂
• Purity: Min. 95%
• Molecular weight: 681.49 g/mol