Semprex-D
(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol;(E)-3-[6-[(E)-1-(4-methylphenyl)-3-pyrrolidin-1-ylprop-1-enyl]-2-pyridinyl]prop-2-enoic acid;hydrochloride
Molecular Identity
Semprex-D
(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol;(E)-3-[6-[(E)-1-(4-methylphenyl)-3-pyrrolidin-1-ylprop-1-enyl]-2-pyridinyl]prop-2-enoic acid;hydrochloride
PubChem CID: 44148932
2D Structure
Properties
C32H40ClN3O3
Molecular Formula
550.10
Molecular Weight
g/mol
549.2758
Exact Mass
Da
85.7
TPSA
Good oral absorption (< 140 A²)
4
H-Bond Donors
6
H-Bond Acceptors
635
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(8)
Semprex-DRefChem:58636Acrivastine; pseudoephedrine hydrochlorideDuactAcrivastine and pseudoephedrineAcrivastine and pseudoephedrine hydrochloride926042-19-52-Propenoic acid, 3-(6-((1E)-1-(4-methylphenyl)-3-(1-pyrrolidinyl)-1-propen-1-yl)-2-pyridinyl)-, (2E)-, mixt. with alphaS,alpha-((1S)-1-(methylamino)ethyl)benzenemethanol hydrochloride (1:1)
Data from PubChem (NCBI)
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