ChemSpider 2D Image | N-Methyl-1-{1-[(1-methyl-1H-tetrazol-5-yl)methyl]-3-pyrrolidinyl}-N-[(4-methyl-1,3-thiazol-5-yl)methyl]methanamine | C14H23N7S

N-Methyl-1-{1-[(1-methyl-1H-tetrazol-5-yl)methyl]-3-pyrrolidinyl}-N-[(4-methyl-1,3-thiazol-5-yl)methyl]methanamine

  • Molecular FormulaC14H23N7S
  • Average mass321.444 Da
  • Monoisotopic mass321.173553 Da
  • ChemSpider ID63169028

More details:






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

5-Thiazolemethanamine, N,4-dimethyl-N-[[1-[(1-methyl-1H-tetrazol-5-yl)methyl]-3-pyrrolidinyl]methyl]- [ACD/Index Name]
N-Methyl-1-{1-[(1-methyl-1H-tetrazol-5-yl)methyl]-3-pyrrolidinyl}-N-[(4-methyl-1,3-thiazol-5-yl)methyl]methanamin [German] [ACD/IUPAC Name]
N-Methyl-1-{1-[(1-methyl-1H-tetrazol-5-yl)methyl]-3-pyrrolidinyl}-N-[(4-methyl-1,3-thiazol-5-yl)methyl]methanamine [ACD/IUPAC Name]
N-Méthyl-1-{1-[(1-méthyl-1H-tétrazol-5-yl)méthyl]-3-pyrrolidinyl}-N-[(4-méthyl-1,3-thiazol-5-yl)méthyl]méthanamine [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 496.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.4±3.0 kJ/mol
Flash Point: 254.2±27.3 °C
Index of Refraction: 1.697
Molar Refractivity: 90.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.15
ACD/LogD (pH 5.5): -3.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.01
Polar Surface Area: 91 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 54.1±7.0 dyne/cm
Molar Volume: 235.6±7.0 cm3

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