ChemSpider 2D Image | N-{[1-(Cyclopropylmethyl)-2-pyrrolidinyl]methyl}-5-(ethylsulfonyl)-4-iodo-2-methoxybenzamide | C19H27IN2O4S

N-{[1-(Cyclopropylmethyl)-2-pyrrolidinyl]methyl}-5-(ethylsulfonyl)-4-iodo-2-methoxybenzamide

  • Molecular FormulaC19H27IN2O4S
  • Average mass506.398 Da
  • Monoisotopic mass506.073608 Da
  • ChemSpider ID109019

More details:

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

Benzamide, N-[[1-(cyclopropylmethyl)-2-pyrrolidinyl]methyl]-5-(ethylsulfonyl)-4-iodo-2-methoxy- [ACD/Index Name]
N-{[1-(Cyclopropylmethyl)-2-pyrrolidinyl]methyl}-5-(ethylsulfonyl)-4-iod-2-methoxybenzamid [German] [ACD/IUPAC Name]
N-{[1-(Cyclopropylmethyl)-2-pyrrolidinyl]methyl}-5-(ethylsulfonyl)-4-iodo-2-methoxybenzamide [ACD/IUPAC Name]
N-{[1-(Cyclopropylméthyl)-2-pyrrolidinyl]méthyl}-5-(éthylsulfonyl)-4-iodo-2-méthoxybenzamide [French] [ACD/IUPAC Name]
N-{[1-(Cyclopropylmethyl)pyrrolidin-2-yl]methyl}-5-(ethylsulfonyl)-4-iodo-2-methoxybenzamide
100038-54-8 [RN]
Benzamide, N-((1-(cyclopropylmethyl)-2-pyrrolidinyl)methyl)-5-(ethylsulfonyl)-4-iodo-2-methoxy-
iodosulpride
N-((1-Cyclopropylmethyl-2-pyrrolidinyl)methyl)-2-methoxy-4-iodo-5-ethylsulfonylbenzamide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 592.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 312.2±30.1 °C
Index of Refraction: 1.592
Molar Refractivity: 113.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.01
ACD/LogD (pH 5.5): -0.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.59
Polar Surface Area: 84 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 336.8±3.0 cm3

Click to predict properties on the Chemicalize site


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