ChemSpider 2D Image | 1-(1-Benzyl-1H-tetrazol-5-yl)-1-(3,4-dimethoxyphenyl)-N-(2-furylmethyl)-N-(3-methoxybenzyl)methanamine | C30H31N5O4

1-(1-Benzyl-1H-tetrazol-5-yl)-1-(3,4-dimethoxyphenyl)-N-(2-furylmethyl)-N-(3-methoxybenzyl)methanamine

  • Molecular FormulaC30H31N5O4
  • Average mass525.598 Da
  • Monoisotopic mass525.237610 Da
  • ChemSpider ID2480438

More details:

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

1-(1-Benzyl-1H-tetrazol-5-yl)-1-(3,4-dimethoxyphenyl)-N-(2-furylmethyl)-N-(3-methoxybenzyl)methanamin [German] [ACD/IUPAC Name]
1-(1-Benzyl-1H-tetrazol-5-yl)-1-(3,4-dimethoxyphenyl)-N-(2-furylmethyl)-N-(3-methoxybenzyl)methanamine [ACD/IUPAC Name]
1-(1-Benzyl-1H-tétrazol-5-yl)-1-(3,4-diméthoxyphényl)-N-(2-furylméthyl)-N-(3-méthoxybenzyl)méthanamine [French] [ACD/IUPAC Name]
1H-Tetrazole-5-methanamine, α-(3,4-dimethoxyphenyl)-N-(2-furanylmethyl)-N-[(3-methoxyphenyl)methyl]-1-(phenylmethyl)- [ACD/Index Name]

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

ASN 07887953 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 686.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.7±3.0 kJ/mol
Flash Point: 369.1±31.5 °C
Index of Refraction: 1.613
Molar Refractivity: 150.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.28
ACD/LogD (pH 5.5): 5.30
ACD/BCF (pH 5.5): 6305.20
ACD/KOC (pH 5.5): 18210.75
ACD/LogD (pH 7.4): 5.31
ACD/BCF (pH 7.4): 6360.34
ACD/KOC (pH 7.4): 18369.98
Polar Surface Area: 88 Å2
Polarizability: 59.5±0.5 10-24cm3
Surface Tension: 45.5±7.0 dyne/cm
Molar Volume: 431.3±7.0 cm3

Click to predict properties on the Chemicalize site


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