ChemSpider 2D Image | N-[3-({[4-({2-[(1-Isopropyl-3-pyrrolidinyl)methyl]-4-pyridinyl}oxy)-1-naphthyl]carbamoyl}amino)-2-methoxy-5-(2-methyl-2-propanyl)phenyl]methanesulfonamide | C36H45N5O5S

N-[3-({[4-({2-[(1-Isopropyl-3-pyrrolidinyl)methyl]-4-pyridinyl}oxy)-1-naphthyl]carbamoyl}amino)-2-methoxy-5-(2-methyl-2-propanyl)phenyl]methanesulfonamide

  • Molecular FormulaC36H45N5O5S
  • Average mass659.838 Da
  • Monoisotopic mass659.314148 Da
  • ChemSpider ID8297953

More details:

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

Methanesulfonamide, N-[5-(1,1-dimethylethyl)-2-methoxy-3-[[[[4-[[2-[[1-(1-methylethyl)-3-pyrrolidinyl]methyl]-4-pyridinyl]oxy]-1-naphthalenyl]amino]carbonyl]amino]phenyl]- [ACD/Index Name]
N-[3-({[4-({2-[(1-Isopropyl-3-pyrrolidinyl)methyl]-4-pyridinyl}oxy)-1-naphthyl]carbamoyl}amino)-2-methoxy-5-(2-methyl-2-propanyl)phenyl]methanesulfonamide [ACD/IUPAC Name]
N-[3-({[4-({2-[(1-Isopropyl-3-pyrrolidinyl)methyl]-4-pyridinyl}oxy)-1-naphthyl]carbamoyl}amino)-2-methoxy-5-(2-methyl-2-propanyl)phenyl]methansulfonamid [German] [ACD/IUPAC Name]
N-[3-({[4-({2-[(1-Isopropyl-3-pyrrolidinyl)méthyl]-4-pyridinyl}oxy)-1-naphtyl]carbamoyl}amino)-2-méthoxy-5-(2-méthyl-2-propanyl)phényl]méthanesulfonamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.635
Molar Refractivity: 186.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 7.45
ACD/LogD (pH 5.5): 3.17
ACD/BCF (pH 5.5): 21.57
ACD/KOC (pH 5.5): 31.42
ACD/LogD (pH 7.4): 4.09
ACD/BCF (pH 7.4): 182.29
ACD/KOC (pH 7.4): 265.55
Polar Surface Area: 130 Å2
Polarizability: 73.8±0.5 10-24cm3
Surface Tension: 59.5±3.0 dyne/cm
Molar Volume: 519.7±3.0 cm3

Click to predict properties on the Chemicalize site


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