Tenapanor
1-[2-[2-[2-[[3-[(4S)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]sulfonylamino]ethoxy]ethoxy]ethyl]-3-[4-[2-[2-[2-[[3-[(4S)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]sulfonylamino]ethoxy]ethoxy]ethylcarbamoylamino]butyl]urea
Molecular Identity
Tenapanor
1-[2-[2-[2-[[3-[(4S)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]sulfonylamino]ethoxy]ethoxy]ethyl]-3-[4-[2-[2-[2-[[3-[(4S)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]sulfonylamino]ethoxy]ethoxy]ethylcarbamoylamino]butyl]urea
PubChem CID: 71587953
2D Structure
Properties
C50H66Cl4N8O10S2
Molecular Formula
1145.00
Molecular Weight
g/mol
1144.3068
Exact Mass
Da
5.1
XLogP
Above Lipinski threshold
235
TPSA
May have limited oral absorption
6
H-Bond Donors
14
H-Bond Acceptors
1770
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Tenapanor1234423-95-0AZD1722AZD-1722KHK-7791KHK7791WYD79216A6DTXSID401540161-[2-[2-[2-[[3-[(4S)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]sulfonylamino]ethoxy]ethoxy]ethyl]-3-[4-[2-[2-[2-[[3-[(4S)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]sulfonylamino]ethoxy]ethoxy]ethylcarbamoylamino]butyl]ureaN,N'-(10,17,-Dioxo-3,6,21,24-tetraoxa-9,11,16,18-tetraazahexacosane-1,26-diyl)bis(((4S)-6,8-dichloro-2-methyl-1,2,3,4-tetrahydroisoquinolin-4-yl)benzenesulfonamide)tenapanorum1-(2-(2-(2-((3-((4S)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl)sulfonylamino)ethoxy)ethoxy)ethyl)-3-(4-(2-(2-(2-((3-((4S)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl)sulfonylamino)ethoxy)ethoxy)ethylcarbamoylamino)butyl)ureaRefChem:58054DTXCID907650717-(((3-((4S)-6,8-Dichloro-1,2,3,4-tetrahydro-2-methyl-4-isoquinolinyl)phenyl)sulfonyl)amino)-N-(2-(2-(2-(((3-((4S)-6,8-dichloro-1,2,3,4-tetrahydro-2-methyl-4-isoquinolinyl)phenyl)sulfonyl)amino)ethoxy)ethoxy)ethyl)-8-oxo-12,15-dioxa-2,7,9-triazaheptadecanamide
Data from PubChem (NCBI)
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