ChemSpider 2D Image | N-(3-Butoxypropyl)-N'-(3,4-diethoxyphenyl)-6-[4-(dimethylamino)-1-piperidinyl]-1,3,5-triazine-2,4-diamine | C27H45N7O3

N-(3-Butoxypropyl)-N'-(3,4-diethoxyphenyl)-6-[4-(dimethylamino)-1-piperidinyl]-1,3,5-triazine-2,4-diamine

  • Molecular FormulaC27H45N7O3
  • Average mass515.691 Da
  • Monoisotopic mass515.358398 Da
  • ChemSpider ID124620760

More details:

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

1,3,5-Triazine-2,4-diamine, N2-(3-butoxypropyl)-N4-(3,4-diethoxyphenyl)-6-[4-(dimethylamino)-1-piperidinyl]- [ACD/Index Name]
N-(3-Butoxypropyl)-N'-(3,4-diethoxyphenyl)-6-[4-(dimethylamino)-1-piperidinyl]-1,3,5-triazin-2,4-diamin [German] [ACD/IUPAC Name]
N-(3-Butoxypropyl)-N'-(3,4-diethoxyphenyl)-6-[4-(dimethylamino)-1-piperidinyl]-1,3,5-triazine-2,4-diamine [ACD/IUPAC Name]
N-(3-Butoxypropyl)-N'-(3,4-diéthoxyphényl)-6-[4-(diméthylamino)-1-pipéridinyl]-1,3,5-triazine-2,4-diamine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 655.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.5±3.0 kJ/mol
Flash Point: 349.9±34.3 °C
Index of Refraction: 1.569
Molar Refractivity: 146.4±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 3.25
ACD/LogD (pH 5.5): 0.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.13
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 22.00
ACD/KOC (pH 7.4): 128.48
Polar Surface Area: 97 Å2
Polarizability: 58.0±0.5 10-24cm3
Surface Tension: 54.9±5.0 dyne/cm
Molar Volume: 447.1±5.0 cm3

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