ChemSpider 2D Image | AR-709 | C27H27ClN6O4

AR-709

  • Molecular FormulaC27H27ClN6O4
  • Average mass534.994 Da
  • Monoisotopic mass534.178223 Da
  • ChemSpider ID9401466

More details:






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

1H-Indole-2-carboxamide, 5-chloro-3-[[4-[(2,4-diamino-5-pyrimidinyl)methyl]-6,7-dimethoxy-2-benzofuranyl]methyl]-N,N-dimethyl- [ACD/Index Name]
5-Chlor-3-({4-[(2,4-diamino-5-pyrimidinyl)methyl]-6,7-dimethoxy-1-benzofuran-2-yl}methyl)-N,N-dimethyl-1H-indol-2-carboxamid [German] [ACD/IUPAC Name]
5-Chloro-3-({4-[(2,4-diamino-5-pyrimidinyl)methyl]-6,7-dimethoxy-1-benzofuran-2-yl}methyl)-N,N-dimethyl-1H-indole-2-carboxamide [ACD/IUPAC Name]
5-Chloro-3-({4-[(2,4-diamino-5-pyrimidinyl)méthyl]-6,7-diméthoxy-1-benzofuran-2-yl}méthyl)-N,N-diméthyl-1H-indole-2-carboxamide [French] [ACD/IUPAC Name]
5-chloro-3-({4-[(2,4-diaminopyrimidin-5-yl)methyl]-6,7-dimethoxy-1-benzofuran-2-yl}methyl)-N,N-dimethyl-1H-indole-2-carboxamide
663214-64-0 [RN]
AR-709
QUA6EJN8TL
5-chloro-3-((4-((2,4-diaminopyrimidin-5-yl)methyl)-6,7-dimethoxybenzofuran-2-yl)methyl)-N,N-dimethyl-1H-indole-2-carboxamide
5-chloro-3-[[4-[(2,4-diamino-5-pyrimidinyl)methyl]-6,7-dimethoxy-2-benzofuranyl]methyl]-N,N-dimethyl-1H-indole-2-carboxamide
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 839.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 122.0±3.0 kJ/mol
Flash Point: 461.7±37.1 °C
Index of Refraction: 1.701
Molar Refractivity: 148.6±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 1.92
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 7.65
ACD/KOC (pH 5.5): 63.19
ACD/LogD (pH 7.4): 3.09
ACD/BCF (pH 7.4): 124.98
ACD/KOC (pH 7.4): 1031.99
Polar Surface Area: 146 Å2
Polarizability: 58.9±0.5 10-24cm3
Surface Tension: 65.1±3.0 dyne/cm
Molar Volume: 383.8±3.0 cm3

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