Found 20 results

Search term: MF = 'C_{34}H_{44}N_{8}O_{3}'
ChemSpider 2D Image | N-[(1S,2R,3S,4R)-4-(6-[(Diphenylmethyl)amino]-2-{[2-(1-piperidinyl)ethyl]amino}-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]-2-methylpropanamide | C34H44N8O3

N-[(1S,2R,3S,4R)-4-(6-[(Diphenylmethyl)amino]-2-{[2-(1-piperidinyl)ethyl]amino}-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]-2-methylpropanamide

  • Molecular FormulaC34H44N8O3
  • Average mass612.765 Da
  • Monoisotopic mass612.353638 Da
  • ChemSpider ID9767277

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

N-[(1S,2R,3S,4R)-4-(6-[(Diphenylmethyl)amino]-2-{[2-(1-piperidinyl)ethyl]amino}-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]-2-methylpropanamid [German] [ACD/IUPAC Name]
N-[(1S,2R,3S,4R)-4-(6-[(Diphenylmethyl)amino]-2-{[2-(1-piperidinyl)ethyl]amino}-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]-2-methylpropanamide [ACD/IUPAC Name]
N-[(1S,2R,3S,4R)-4-(6-[(Diphénylméthyl)amino]-2-{[2-(1-pipéridinyl)éthyl]amino}-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]-2-méthylpropanamide [French] [ACD/IUPAC Name]
Propanamide, N-[(1S,2R,3S,4R)-4-[6-[(diphenylmethyl)amino]-2-[[2-(1-piperidinyl)ethyl]amino]-9H-purin-9-yl]-2,3-dihydroxycyclopentyl]-2-methyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.697
Molar Refractivity: 172.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 2.53
ACD/LogD (pH 5.5): 1.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.67
ACD/LogD (pH 7.4): 2.43
ACD/BCF (pH 7.4): 17.61
ACD/KOC (pH 7.4): 97.67
Polar Surface Area: 140 Å2
Polarizability: 68.3±0.5 10-24cm3
Surface Tension: 56.5±7.0 dyne/cm
Molar Volume: 447.6±7.0 cm3

Click to predict properties on the Chemicalize site


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