Serdexmethylphenidate
(2S)-3-hydroxy-2-[[1-[[(2R)-2-[(1R)-2-methoxy-2-oxo-1-phenylethyl]piperidine-1-carbonyl]oxymethyl]pyridin-1-ium-3-carbonyl]amino]propanoate
Molecular Identity
Serdexmethylphenidate
(2S)-3-hydroxy-2-[[1-[[(2R)-2-[(1R)-2-methoxy-2-oxo-1-phenylethyl]piperidine-1-carbonyl]oxymethyl]pyridin-1-ium-3-carbonyl]amino]propanoate
PubChem CID: 134823895
2D Structure
Properties
C25H29N3O8
Molecular Formula
499.50
Molecular Weight
g/mol
499.1955
Exact Mass
Da
2.2
XLogP
Drug-like (Lipinski: < 5)
149
TPSA
May have limited oral absorption
2
H-Bond Donors
8
H-Bond Acceptors
767
Complexity
SMILES
Canonical SMILES
SMILES: COC(=O)C(C1CCCCN1C(=O)OC[N+]2=CC=CC(=C2)C(=O)NC(CO)C(=O)[O-])C3=CC=CC=C3Isomeric SMILES
SMILES: COC(=O)[C@@H]([C@H]1CCCCN1C(=O)OC[N+]2=CC=CC(=C2)C(=O)N[C@@H](CO)C(=O)[O-])C3=CC=CC=C3Synonyms(20)
SerdexmethylphenidateKP-415 inner salt0H8KZ470DWUNII-0H8KZ470DW1996626-29-9KP484SERDEXMETHYLPHENIDATE [INN]KP-484SERDEXMETHYLPHENIDATE [WHO-DD](2S)-3-hydroxy-2-[[1-[[(2R)-2-[(1R)-2-methoxy-2-oxo-1-phenylethyl]piperidine-1-carbonyl]oxymethyl]pyridin-1-ium-3-carbonyl]amino]propanoatePyridinium, 3-((((1S)-1-carboxy-2-hydroxyethyl)amino)carbonyl)-1-(((((2R)-2-((1R)-2-methoxy-2-oxo-1-phenylethyl)-1-piperidinyl)carbonyl)oxy)methyl)-serdexmetilfenidatoAzstarys (serdexmethylphenidate + dexmethylphenidate)N-(1-((((2R)-2-((1R)-2-METHOXY-2-OXO-1-PHENYLETHYL)PIPERIDINE-1-CARBONYL)OXY)METHYL)PYRIDIN-1-IUM-3-CARBONYL)-L-SERINATE(2S)-3-hydroxy-2-((1-(((2R)-2-((1R)-2-methoxy-2-oxo-1-phenylethyl)piperidine-1-carbonyl)oxymethyl)pyridin-1-ium-3-carbonyl)amino)propanoate
Data from PubChem (NCBI)
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