Olodanrigan
(3S)-2-(2,2-diphenylacetyl)-6-methoxy-5-phenylmethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Molecular Identity
Olodanrigan
(3S)-2-(2,2-diphenylacetyl)-6-methoxy-5-phenylmethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
PubChem CID: 9937291
2D Structure
Properties
C32H29NO5
Molecular Formula
507.60
Molecular Weight
g/mol
507.2046
Exact Mass
Da
5.6
XLogP
Above Lipinski threshold
76.1
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
752
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Olodanrigan1316755-16-4PD-126055P0FN522VTO(3S)-2-(2,2-diphenylacetyl)-6-methoxy-5-phenylmethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid(3S)-2-(2,2-Diphenylacetyl)-1,2,3,4-tetrahydro-6-methoxy-5-(phenylmethoxy)-3-isoquinolinecarboxylic acid3-Isoquinolinecarboxylic acid, 2-(2,2-diphenylacetyl)-1,2,3,4-tetrahydro-6-methoxy-5-(phenylmethoxy)-, (3S)-olodanriganumRefChem:1050288EMA401PD-126055 free acidEMA-401MFCD28502251Olodanrigan [WHO-DD]Olodanrigan (EMA401)
Data from PubChem (NCBI)
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