ChemSpider 2D Image | AZD-4877 | C28H33N5O2S

AZD-4877

  • Molecular FormulaC28H33N5O2S
  • Average mass503.659 Da
  • Monoisotopic mass503.235504 Da
  • ChemSpider ID8544260

More details:






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

1176760-49-8 [RN]
19ORU63E06
AZD-4877
Benzamide, N-(3-aminopropyl)-N-[1-[4,5-dihydro-3-methyl-4-oxo-5-(phenylmethyl)isothiazolo[5,4-d]pyrimidin-6-yl]-2-methylpropyl]-4-methyl- [ACD/Index Name]
N-(3-Aminopropyl)-N-[1-(5-benzyl-3-methyl-4-oxo-4,5-dihydro[1,2]thiazolo[5,4-d]pyrimidin-6-yl)-2-methylpropyl]-4-methylbenzamid [German] [ACD/IUPAC Name]
N-(3-Aminopropyl)-N-[1-(5-benzyl-3-methyl-4-oxo-4,5-dihydro[1,2]thiazolo[5,4-d]pyrimidin-6-yl)-2-methylpropyl]-4-methylbenzamide [ACD/IUPAC Name]
N-(3-Aminopropyl)-N-[1-(5-benzyl-3-méthyl-4-oxo-4,5-dihydro[1,2]thiazolo[5,4-d]pyrimidin-6-yl)-2-méthylpropyl]-4-méthylbenzamide [French] [ACD/IUPAC Name]
UNII:19ORU63E06
AZD 4877
AZD 4877|AZD-4877|cc-722
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 663.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.6±3.0 kJ/mol
Flash Point: 354.9±34.3 °C
Index of Refraction: 1.647
Molar Refractivity: 146.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.66
ACD/LogD (pH 5.5): -0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.99
ACD/BCF (pH 7.4): 1.15
ACD/KOC (pH 7.4): 10.99
Polar Surface Area: 120 Å2
Polarizability: 57.9±0.5 10-24cm3
Surface Tension: 48.7±7.0 dyne/cm
Molar Volume: 402.1±7.0 cm3

Click to predict properties on the Chemicalize site






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