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Chemical structure of Cinacalcet metabolite M4

GC39251

Cinacalcet metabolite M4

Also known as 3-[3-(trifluoromethyl)phenyl]propan-1-amine

Cinacalcet metabolite M4 is a metabolite of Cinacalcet

ChemicalCAS104774-87-0MW203.2FormulaC10H12F3N
CAS number
104774-87-0
Molecular weight
203.2
Formula
C10H12F3N
Solubility
Soluble in DMSO
InChIKey
JMTLMFBJIQWJPW-UHFFFAOYSA-N
Catalogue number
GC39251
Brand
GLPBIO
Computed properties PubChem CID 19797640 · XLogP 2.5 · TPSA 26 Ų · H-bond donors 1
XLogP
2.5
TPSA
26 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
14

SMILES C1=CC(=CC(=C1)C(F)(F)F)CCCN

Computed descriptors from PubChem (CID 19797640), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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