Found 287 results

Search term: MF = 'C_{33}H_{45}N_{5}O_{2}'
ChemSpider 2D Image | N-[4-(1,4'-Bipiperidin-1'-yl)phenyl]-4-[5-(2-methyl-2-propanyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl]butanamide | C33H45N5O2

N-[4-(1,4'-Bipiperidin-1'-yl)phenyl]-4-[5-(2-methyl-2-propanyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl]butanamide

  • Molecular FormulaC33H45N5O2
  • Average mass543.743 Da
  • Monoisotopic mass543.357300 Da
  • ChemSpider ID8341397

More details:

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

1H-1,4-Benzodiazepine-1-butanamide, N-(4-[1,4'-bipiperidin]-1'-ylphenyl)-5-(1,1-dimethylethyl)-2,3-dihydro-2-oxo- [ACD/Index Name]
N-[4-(1,4'-Bipiperidin-1'-yl)phenyl]-4-[5-(2-methyl-2-propanyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl]butanamid [German] [ACD/IUPAC Name]
N-[4-(1,4'-Bipiperidin-1'-yl)phenyl]-4-[5-(2-methyl-2-propanyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl]butanamide [ACD/IUPAC Name]
N-[4-(1,4'-Bipipéridin-1'-yl)phényl]-4-[5-(2-méthyl-2-propanyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazépin-1-yl]butanamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 769.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.0±3.0 kJ/mol
Flash Point: 419.1±32.9 °C
Index of Refraction: 1.621
Molar Refractivity: 161.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 1.56
ACD/BCF (pH 5.5): 1.58
ACD/KOC (pH 5.5): 6.10
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 17.02
ACD/KOC (pH 7.4): 65.61
Polar Surface Area: 68 Å2
Polarizability: 64.0±0.5 10-24cm3
Surface Tension: 46.5±7.0 dyne/cm
Molar Volume: 459.5±7.0 cm3

Click to predict properties on the Chemicalize site


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