Found 25 results

Search term: MF = 'C_{19}H_{16}N_{8}OS'
ChemSpider 2D Image | 2-Amino-4-[4-(cyclopropylmethoxy)phenyl]-6-[(1H-tetrazol-5-ylmethyl)sulfanyl]-3,5-pyridinedicarbonitrile | C19H16N8OS

2-Amino-4-[4-(cyclopropylmethoxy)phenyl]-6-[(1H-tetrazol-5-ylmethyl)sulfanyl]-3,5-pyridinedicarbonitrile

  • Molecular FormulaC19H16N8OS
  • Average mass404.448 Da
  • Monoisotopic mass404.116791 Da
  • ChemSpider ID90630916

More details:

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

2-Amino-4-[4-(cyclopropylmethoxy)phenyl]-6-[(1H-tetrazol-5-ylmethyl)sulfanyl]-3,5-pyridindicarbonitril [German] [ACD/IUPAC Name]
2-Amino-4-[4-(cyclopropylmethoxy)phenyl]-6-[(1H-tetrazol-5-ylmethyl)sulfanyl]-3,5-pyridinedicarbonitrile [ACD/IUPAC Name]
2-Amino-4-[4-(cyclopropylméthoxy)phényl]-6-[(1H-tétrazol-5-ylméthyl)sulfanyl]-3,5-pyridinedicarbonitrile [French] [ACD/IUPAC Name]
3,5-Pyridinedicarbonitrile, 2-amino-4-[4-(cyclopropylmethoxy)phenyl]-6-[(1H-tetrazol-5-ylmethyl)thio]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 712.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.2±3.0 kJ/mol
Flash Point: 384.9±35.7 °C
Index of Refraction: 1.720
Molar Refractivity: 104.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.72
ACD/LogD (pH 5.5): 0.96
ACD/BCF (pH 5.5): 1.42
ACD/KOC (pH 5.5): 17.25
ACD/LogD (pH 7.4): 0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.10
Polar Surface Area: 175 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 107.9±5.0 dyne/cm
Molar Volume: 265.6±5.0 cm3

Click to predict properties on the Chemicalize site


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