ChemSpider 2D Image | YM44778 | C34H39Cl2N3O5

YM44778

  • Molecular FormulaC34H39Cl2N3O5
  • Average mass640.597 Da
  • Monoisotopic mass639.226685 Da
  • ChemSpider ID8028085

More details:

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

Benzamide, N-[2-(3,4-dichlorophenyl)-4-(3,4-dihydro-3-oxospiro[isoquinoline-1(2H),4'-piperidin]-1'-yl)butyl]-3,4,5-trimethoxy-N-methyl- [ACD/Index Name]
N-[2-(3,4-Dichlorophenyl)-4-(3-oxo-3,4-dihydro-1'H,2H-spiro[isoquinoline-1,4'-piperidin]-1'-yl)butyl]-3,4,5-trimethoxy-N-methylbenzamide [ACD/IUPAC Name]
N-[2-(3,4-Dichlorophényl)-4-(3-oxo-3,4-dihydro-1'H,2H-spiro[isoquinoline-1,4'-piperidin]-1'-yl)butyl]-3,4,5-triméthoxy-N-méthylbenzamide [French] [ACD/IUPAC Name]
N-[2-(3,4-Dichlorphenyl)-4-(3-oxo-3,4-dihydro-1'H,2H-spiro[isoquinoline-1,4'-piperidin]-1'-yl)butyl]-3,4,5-trimethoxy-N-methylbenzamid [German] [ACD/IUPAC Name]
YM44778
173941-74-7 [RN]
N-[2-(3,4-dichlorophenyl)-4-(3-oxospiro[2,4-dihydroisoquinoline-1,4'-piperidine]-1'-yl)butyl]-3,4,5-trimethoxy-N-methylbenzamide
YM-44778

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

Density: 1.3±0.1 g/cm3
Boiling Point: 827.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 120.3±3.0 kJ/mol
Flash Point: 454.4±34.3 °C
Index of Refraction: 1.633
Molar Refractivity: 172.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.68
ACD/LogD (pH 5.5): 2.59
ACD/BCF (pH 5.5): 10.81
ACD/KOC (pH 5.5): 27.99
ACD/LogD (pH 7.4): 3.99
ACD/BCF (pH 7.4): 269.23
ACD/KOC (pH 7.4): 697.26
Polar Surface Area: 80 Å2
Polarizability: 68.5±0.5 10-24cm3
Surface Tension: 60.2±5.0 dyne/cm
Molar Volume: 483.6±5.0 cm3

Click to predict properties on the Chemicalize site


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