ChemSpider 2D Image | Tenapanor | C50H66Cl4N8O10S2

Tenapanor

  • Molecular FormulaC50H66Cl4N8O10S2
  • Average mass1145.049 Da
  • Monoisotopic mass1142.309692 Da
  • ChemSpider ID32056950
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1234423-95-0 [RN]
9652
Benzenesulfonamide, N,N'-(10,17-dioxo-3,6,21,24-tetraoxa-9,11,16,18-tetraazahexacosane-1,26-diyl)bis[3-[(4S)-6,8-dichloro-1,2,3,4-tetrahydro-2-methyl-4-isoquinolinyl]- [ACD/Index Name]
N,N'-(10,17-Dioxo-3,6,21,24-tetraoxa-9,11,16,18-tetraazahexacosan-1,26-diyl)bis{3-[(4S)-6,8-dichlor-2-methyl-1,2,3,4-tetrahydro-4-isochinolinyl]benzolsulfonamid} [German] [ACD/IUPAC Name]
N,N'-(10,17-Dioxo-3,6,21,24-tétraoxa-9,11,16,18-tétraazahexacosane-1,26-diyl)bis{3-[(4S)-6,8-dichloro-2-méthyl-1,2,3,4-tétrahydro-4-isoquinoléinyl]benzènesulfonamide} [French] [ACD/IUPAC Name]
N,N'-(10,17-Dioxo-3,6,21,24-tetraoxa-9,11,16,18-tetraazahexacosane-1,26-diyl)bis{3-[(4S)-6,8-dichloro-2-methyl-1,2,3,4-tetrahydro-4-isoquinolinyl]benzenesulfonamide} [ACD/IUPAC Name]
Tenapanor [Wiki]
WYD79216A6
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
AZD1722
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.590
Molar Refractivity: 291.0±0.4 cm3
#H bond acceptors: 18
#H bond donors: 6
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 3
ACD/LogP: 4.85
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 133.71
ACD/KOC (pH 5.5): 272.01
ACD/LogD (pH 7.4): 5.94
ACD/BCF (pH 7.4): 18444.64
ACD/KOC (pH 7.4): 37523.65
Polar Surface Area: 235 Å2
Polarizability: 115.3±0.5 10-24cm3
Surface Tension: 52.2±3.0 dyne/cm
Molar Volume: 862.5±3.0 cm3

Click to predict properties on the Chemicalize site





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