ChemSpider 2D Image | (4r)-N-(Biphenyl-4-Ylmethyl)-4-Hydroxy-1-[(3-Methylisoxazol-5-Yl)acetyl]-L-Prolinamide | C24H25N3O4

(4r)-N-(Biphenyl-4-Ylmethyl)-4-Hydroxy-1-[(3-Methylisoxazol-5-Yl)acetyl]-L-Prolinamide

  • Molecular FormulaC24H25N3O4
  • Average mass419.473 Da
  • Monoisotopic mass419.184509 Da
  • ChemSpider ID35034434

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R)-N-(4-Biphenylylmethyl)-4-hydroxy-1-[(3-methyl-1,2-oxazol-5-yl)acetyl]-L-prolinamid [German] [ACD/IUPAC Name]
(4R)-N-(4-Biphenylylmethyl)-4-hydroxy-1-[(3-methyl-1,2-oxazol-5-yl)acetyl]-L-prolinamide [ACD/IUPAC Name]
(4R)-N-(4-Biphénylylméthyl)-4-hydroxy-1-[2-(3-méthyl-1,2-oxazol-5-yl)acétyl]-L-prolinamide [French] [ACD/IUPAC Name]
(4r)-N-(Biphenyl-4-Ylmethyl)-4-Hydroxy-1-[(3-Methylisoxazol-5-Yl)acetyl]-L-Prolinamide
2-Pyrrolidinecarboxamide, N-([1,1'-biphenyl]-4-ylmethyl)-4-hydroxy-1-[2-(3-methyl-5-isoxazolyl)acetyl]-, (2S,4R)- [ACD/Index Name]
TR0

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

Density: 1.3±0.1 g/cm3
Boiling Point: 752.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 115.0±3.0 kJ/mol
Flash Point: 408.8±32.9 °C
Index of Refraction: 1.617
Molar Refractivity: 114.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.25
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 19.18
ACD/KOC (pH 5.5): 288.38
ACD/LogD (pH 7.4): 1.99
ACD/BCF (pH 7.4): 19.18
ACD/KOC (pH 7.4): 288.38
Polar Surface Area: 96 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 59.3±3.0 dyne/cm
Molar Volume: 327.1±3.0 cm3

Click to predict properties on the Chemicalize site


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