ChemSpider 2D Image | N-{5-tert-butyl-2-methoxy-3-[({4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl}carbamoyl)amino]phenyl}methanesulfonamide | C33H39N5O5S

N-{5-tert-butyl-2-methoxy-3-[({4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl}carbamoyl)amino]phenyl}methanesulfonamide

  • Molecular FormulaC33H39N5O5S
  • Average mass617.758 Da
  • Monoisotopic mass617.267212 Da
  • ChemSpider ID8092692

More details:

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

Methanesulfonamide, N-[5-(1,1-dimethylethyl)-2-methoxy-3-[[[[4-[6-(4-morpholinylmethyl)-3-pyridinyl]-1-naphthalenyl]amino]carbonyl]amino]phenyl]- [ACD/Index Name]
N-{2-Methoxy-5-(2-methyl-2-propanyl)-3-[({4-[6-(4-morpholinylmethyl)-3-pyridinyl]-1-naphthyl}carbamoyl)amino]phenyl}methanesulfonamide [ACD/IUPAC Name]
N-{2-Methoxy-5-(2-methyl-2-propanyl)-3-[({4-[6-(4-morpholinylmethyl)-3-pyridinyl]-1-naphthyl}carbamoyl)amino]phenyl}methansulfonamid [German] [ACD/IUPAC Name]
N-{2-Méthoxy-5-(2-méthyl-2-propanyl)-3-[({4-[6-(4-morpholinylméthyl)-3-pyridinyl]-1-naphtyl}carbamoyl)amino]phényl}méthanesulfonamide [French] [ACD/IUPAC Name]
N-{5-tert-butyl-2-methoxy-3-[({4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl}carbamoyl)amino]phenyl}methanesulfonamide
B10
N-(5-tert-butyl-2-methoxy-3-(3-(4-(6-(morpholinomethyl)pyridin-3-yl)naphthalen-1-yl)ureido)phenyl)methanesulfonamide

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: 1.652
Molar Refractivity: 172.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 4.81
ACD/LogD (pH 5.5): 4.64
ACD/BCF (pH 5.5): 1697.15
ACD/KOC (pH 5.5): 5952.61
ACD/LogD (pH 7.4): 4.89
ACD/BCF (pH 7.4): 3031.92
ACD/KOC (pH 7.4): 10634.18
Polar Surface Area: 130 Å2
Polarizability: 68.3±0.5 10-24cm3
Surface Tension: 63.0±3.0 dyne/cm
Molar Volume: 471.1±3.0 cm3

Click to predict properties on the Chemicalize site


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