Found 358 results

Search term: MF = 'C_{11}H_{11}N_{7}OS'
ChemSpider 2D Image | 3-{2-[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}pyrido[3,4-d]pyrimidin-4(3H)-one | C11H11N7OS

3-{2-[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}pyrido[3,4-d]pyrimidin-4(3H)-one

  • Molecular FormulaC11H11N7OS
  • Average mass289.316 Da
  • Monoisotopic mass289.074585 Da
  • ChemSpider ID58849429

More details:

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

3-{2-[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}pyrido[3,4-d]pyrimidin-4(3H)-on [German] [ACD/IUPAC Name]
3-{2-[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}pyrido[3,4-d]pyrimidin-4(3H)-one [ACD/IUPAC Name]
3-{2-[(1-Méthyl-1H-tétrazol-5-yl)sulfanyl]éthyl}pyrido[3,4-d]pyrimidin-4(3H)-one [French] [ACD/IUPAC Name]
Pyrido[3,4-d]pyrimidin-4(3H)-one, 3-[2-[(1-methyl-1H-tetrazol-5-yl)thio]ethyl]- [ACD/Index Name]
3-{2-[(1-methyl-1H-tetrazol-5-yl)thio]ethyl}pyrido[3,4-d]pyrimidin-4(3H)-one

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

Density: 1.6±0.1 g/cm3
Boiling Point: 564.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 295.5±32.9 °C
Index of Refraction: 1.803
Molar Refractivity: 77.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.46
ACD/LogD (pH 5.5): -0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 17.70
ACD/LogD (pH 7.4): -0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.75
Polar Surface Area: 114 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 74.4±7.0 dyne/cm
Molar Volume: 180.3±7.0 cm3

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