ChemSpider 2D Image | 4-{1-[2-(1H-Indol-3-yl)ethyl]-3-piperidinyl}-N-(2-methoxyethyl)-2-pyrimidinamine | C22H29N5O

4-{1-[2-(1H-Indol-3-yl)ethyl]-3-piperidinyl}-N-(2-methoxyethyl)-2-pyrimidinamine

  • Molecular FormulaC22H29N5O
  • Average mass379.499 Da
  • Monoisotopic mass379.237213 Da
  • ChemSpider ID24717179

More details:

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

2-Pyrimidinamine, 4-[1-[2-(1H-indol-3-yl)ethyl]-3-piperidinyl]-N-(2-methoxyethyl)- [ACD/Index Name]
4-{1-[2-(1H-Indol-3-yl)ethyl]-3-piperidinyl}-N-(2-methoxyethyl)-2-pyrimidinamin [German] [ACD/IUPAC Name]
4-{1-[2-(1H-Indol-3-yl)ethyl]-3-piperidinyl}-N-(2-methoxyethyl)-2-pyrimidinamine [ACD/IUPAC Name]
4-{1-[2-(1H-Indol-3-yl)éthyl]-3-pipéridinyl}-N-(2-méthoxyéthyl)-2-pyrimidinamine [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL515573/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 595.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 313.6±32.9 °C
Index of Refraction: 1.637
Molar Refractivity: 114.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.69
ACD/LogD (pH 5.5): 0.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.38
ACD/LogD (pH 7.4): 2.09
ACD/BCF (pH 7.4): 12.38
ACD/KOC (pH 7.4): 102.98
Polar Surface Area: 66 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 58.1±3.0 dyne/cm
Molar Volume: 317.7±3.0 cm3

Click to predict properties on the Chemicalize site


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