ChemSpider 2D Image | 2-Methyl-2-propanyl 4-[2-amino-6-{2-(cyclopropylmethoxy)-6-[(4-methoxybenzyl)oxy]phenyl}-3-(hydroxymethyl)-4-pyridinyl]-1-piperidinecarboxylate | C34H43N3O6

2-Methyl-2-propanyl 4-[2-amino-6-{2-(cyclopropylmethoxy)-6-[(4-methoxybenzyl)oxy]phenyl}-3-(hydroxymethyl)-4-pyridinyl]-1-piperidinecarboxylate

  • Molecular FormulaC34H43N3O6
  • Average mass589.722 Da
  • Monoisotopic mass589.315186 Da
  • ChemSpider ID44209151

More details:

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

1-Piperidinecarboxylic acid, 4-[2-amino-6-[2-(cyclopropylmethoxy)-6-[(4-methoxyphenyl)methoxy]phenyl]-3-(hydroxymethyl)-4-pyridinyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[2-amino-6-{2-(cyclopropylmethoxy)-6-[(4-methoxybenzyl)oxy]phenyl}-3-(hydroxymethyl)-4-pyridinyl]-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[2-amino-6-{2-(cyclopropylmethoxy)-6-[(4-methoxybenzyl)oxy]phenyl}-3-(hydroxymethyl)-4-pyridinyl]-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-[2-Amino-6-{2-(cyclopropylméthoxy)-6-[(4-méthoxybenzyl)oxy]phényl}-3-(hydroxyméthyl)-4-pyridinyl]-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2443747-74-6 [RN]
CS-17176
tert-butyl 4-(2-amino-6-(2-(cyclopropylmethoxy)-6-((4-methoxybenzyl)oxy)phenyl)-3-(hydroxymethyl)pyridin-4-yl)piperidine-1-carboxylate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 712.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.4±3.0 kJ/mol
Flash Point: 384.9±32.9 °C
Index of Refraction: 1.598
Molar Refractivity: 165.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 4.12
ACD/LogD (pH 5.5): 4.30
ACD/BCF (pH 5.5): 861.07
ACD/KOC (pH 5.5): 3342.26
ACD/LogD (pH 7.4): 4.70
ACD/BCF (pH 7.4): 2203.32
ACD/KOC (pH 7.4): 8552.26
Polar Surface Area: 116 Å2
Polarizability: 65.7±0.5 10-24cm3
Surface Tension: 53.0±3.0 dyne/cm
Molar Volume: 485.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement