ChemSpider 2D Image | N-{1-[(7-Carbamimidoyl-2-naphthyl)methyl]-5-[(1-ethanimidoyl-4-piperidinyl)oxy]-2-ethyl-1H-benzimidazol-4-yl}acetamide | C30H35N7O2

N-{1-[(7-Carbamimidoyl-2-naphthyl)methyl]-5-[(1-ethanimidoyl-4-piperidinyl)oxy]-2-ethyl-1H-benzimidazol-4-yl}acetamide

  • Molecular FormulaC30H35N7O2
  • Average mass525.645 Da
  • Monoisotopic mass525.285217 Da
  • ChemSpider ID23123049

More details:

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

Acetamide, N-[1-[[7-(aminoiminomethyl)-2-naphthalenyl]methyl]-2-ethyl-5-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-1H-benzimidazol-4-yl]- [ACD/Index Name]
N-{1-[(7-Carbamimidoyl-2-naphthyl)methyl]-5-[(1-ethanimidoyl-4-piperidinyl)oxy]-2-ethyl-1H-benzimidazol-4-yl}acetamid [German] [ACD/IUPAC Name]
N-{1-[(7-Carbamimidoyl-2-naphthyl)methyl]-5-[(1-ethanimidoyl-4-piperidinyl)oxy]-2-ethyl-1H-benzimidazol-4-yl}acetamide [ACD/IUPAC Name]
N-{1-[(7-Carbamimidoyl-2-naphtyl)méthyl]-5-[(1-ethanimidoyl-4-pipéridinyl)oxy]-2-éthyl-1H-benzimidazol-4-yl}acétamide [French] [ACD/IUPAC Name]
N-{1-[(7-carbamimidoylnaphthalen-2-yl)methyl]-5-[(1-ethanimidoylpiperidin-4-yl)oxy]-2-ethyl-1H-benzimidazol-4-yl}acetamide
CHEMBL280769
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL280769/
N-{1-(7-Carbamimidoyl-naphthalen-2-ylmethyl)-2-ethyl-5-[1-(1-imino-ethyl)-piperidin-4-yloxy]-1H-benzoimidazol-4-yl}-acetamide

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: 1.682
Molar Refractivity: 149.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 1.54
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 133 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 54.1±7.0 dyne/cm
Molar Volume: 394.7±7.0 cm3

Click to predict properties on the Chemicalize site


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