ChemSpider 2D Image | N-{(3R,4R)-1-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]-3-hydroxy-4-piperidinyl}-2-(5-methyl-1H-tetrazol-1-yl)acetamide | C15H23N7O3

N-{(3R,4R)-1-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]-3-hydroxy-4-piperidinyl}-2-(5-methyl-1H-tetrazol-1-yl)acetamide

  • Molecular FormulaC15H23N7O3
  • Average mass349.388 Da
  • Monoisotopic mass349.186249 Da
  • ChemSpider ID57630151

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1H-Tetrazole-1-acetamide, N-[(3R,4R)-1-[(3,5-dimethyl-4-isoxazolyl)methyl]-3-hydroxy-4-piperidinyl]-5-methyl- [ACD/Index Name]
N-{(3R,4R)-1-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]-3-hydroxy-4-piperidinyl}-2-(5-methyl-1H-tetrazol-1-yl)acetamid [German] [ACD/IUPAC Name]
N-{(3R,4R)-1-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]-3-hydroxy-4-piperidinyl}-2-(5-methyl-1H-tetrazol-1-yl)acetamide [ACD/IUPAC Name]
N-{(3R,4R)-1-[(3,5-Diméthyl-1,2-oxazol-4-yl)méthyl]-3-hydroxy-4-pipéridinyl}-2-(5-méthyl-1H-tétrazol-1-yl)acétamide [French] [ACD/IUPAC Name]
N-{rac-(3R,4R)-1-[(3,5-dimethylisoxazol-4-yl)methyl]-3-hydroxypiperidin-4-yl}-2-(5-methyl-1H-tetrazol-1-yl)acetamide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 674.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.1±3.0 kJ/mol
Flash Point: 361.9±31.5 °C
Index of Refraction: 1.700
Molar Refractivity: 89.7±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -2.10
ACD/LogD (pH 5.5): -2.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.84
Polar Surface Area: 122 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 59.3±7.0 dyne/cm
Molar Volume: 232.1±7.0 cm3

Click to predict properties on the Chemicalize site


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