Found 19 results

Search term: MF = 'C_{29}H_{37}N_{9}O'
ChemSpider 2D Image | 2-[4-(1-Piperidinylmethyl)-1H-1,2,3-triazol-1-yl]-N-{7-[4-(3-pyridinyl)-1H-1,2,3-triazol-1-yl]heptyl}benzamide | C29H37N9O

2-[4-(1-Piperidinylmethyl)-1H-1,2,3-triazol-1-yl]-N-{7-[4-(3-pyridinyl)-1H-1,2,3-triazol-1-yl]heptyl}benzamide

  • Molecular FormulaC29H37N9O
  • Average mass527.664 Da
  • Monoisotopic mass527.312134 Da
  • ChemSpider ID127424086

More details:

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

2-[4-(1-Piperidinylmethyl)-1H-1,2,3-triazol-1-yl]-N-{7-[4-(3-pyridinyl)-1H-1,2,3-triazol-1-yl]heptyl}benzamid [German] [ACD/IUPAC Name]
2-[4-(1-Piperidinylmethyl)-1H-1,2,3-triazol-1-yl]-N-{7-[4-(3-pyridinyl)-1H-1,2,3-triazol-1-yl]heptyl}benzamide [ACD/IUPAC Name]
2-[4-(1-Pipéridinylméthyl)-1H-1,2,3-triazol-1-yl]-N-{7-[4-(3-pyridinyl)-1H-1,2,3-triazol-1-yl]heptyl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 2-[4-(1-piperidinylmethyl)-1H-1,2,3-triazol-1-yl]-N-[7-[4-(3-pyridinyl)-1H-1,2,3-triazol-1-yl]heptyl]- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4470375/

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.669
Molar Refractivity: 154.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 2.94
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 3.07
ACD/KOC (pH 5.5): 28.25
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 74.90
ACD/KOC (pH 7.4): 689.06
Polar Surface Area: 107 Å2
Polarizability: 61.3±0.5 10-24cm3
Surface Tension: 54.8±7.0 dyne/cm
Molar Volume: 414.0±7.0 cm3

Click to predict properties on the Chemicalize site


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