ChemSpider 2D Image | N-{4-[(Diaminomethylene)amino]butyl}-5-[3-({4-[(diaminomethylene)amino]butyl}amino)-3-oxo-1-propen-1-yl]-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide | C29H40N8O5

N-{4-[(Diaminomethylene)amino]butyl}-5-[3-({4-[(diaminomethylene)amino]butyl}amino)-3-oxo-1-propen-1-yl]-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide

  • Molecular FormulaC29H40N8O5
  • Average mass580.679 Da
  • Monoisotopic mass580.312195 Da
  • ChemSpider ID3677420

More details:

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

3-Benzofurancarboxamide, N-[4-[(diaminomethylene)amino]butyl]-5-[3-[[4-[(diaminomethylene)amino]butyl]amino]-3-oxo-1-propen-1-yl]-2,3-dihydro-2-(4-hydroxyphenyl)-7-methoxy- [ACD/Index Name]
N-{4-[(Diaminomethylen)amino]butyl}-5-[3-({4-[(diaminomethylen)amino]butyl}amino)-3-oxo-1-propen-1-yl]-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamid [German] [ACD/IUPAC Name]
N-{4-[(Diaminomethylene)amino]butyl}-5-[3-({4-[(diaminomethylene)amino]butyl}amino)-3-oxo-1-propen-1-yl]-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide [ACD/IUPAC Name]
N-{4-[(Diaminométhylène)amino]butyl}-5-[3-({4-[(diaminométhylène)amino]butyl}amino)-3-oxo-1-propén-1-yl]-2-(4-hydroxyphényl)-7-méthoxy-2,3-dihydro-1-benzofurane-3-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.646
Molar Refractivity: 153.6±0.5 cm3
#H bond acceptors: 13
#H bond donors: 11
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: -0.25
ACD/LogD (pH 5.5): -3.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 226 Å2
Polarizability: 60.9±0.5 10-24cm3
Surface Tension: 57.6±7.0 dyne/cm
Molar Volume: 422.9±7.0 cm3

Click to predict properties on the Chemicalize site


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