Found 106 results

Search term: MF = 'C_{21}H_{28}N_{8}O_{2}S'
ChemSpider 2D Image | 1-(6-Ethoxy-4-methyl-2-quinazolinyl)-N-{2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3-piperidinecarboxamide | C21H28N8O2S

1-(6-Ethoxy-4-methyl-2-quinazolinyl)-N-{2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3-piperidinecarboxamide

  • Molecular FormulaC21H28N8O2S
  • Average mass456.564 Da
  • Monoisotopic mass456.205597 Da
  • ChemSpider ID22210792

More details:

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

1-(6-Ethoxy-4-methyl-2-chinazolinyl)-N-{2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3-piperidincarboxamid [German] [ACD/IUPAC Name]
1-(6-Ethoxy-4-methyl-2-quinazolinyl)-N-{2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3-piperidinecarboxamide [ACD/IUPAC Name]
1-(6-Éthoxy-4-méthyl-2-quinazolinyl)-N-{2-[(1-méthyl-1H-tétrazol-5-yl)sulfanyl]éthyl}-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
3-Piperidinecarboxamide, 1-(6-ethoxy-4-methyl-2-quinazolinyl)-N-[2-[(1-methyl-1H-tetrazol-5-yl)thio]ethyl]- [ACD/Index Name]
1-(6-ethoxy-4-methyl-2-quinazolinyl)-N-{2-[(1-methyl-1H-tetrazol-5-yl)thio]ethyl}-3-piperidinecarboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.704
Molar Refractivity: 124.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.12
ACD/LogD (pH 5.5): 0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.44
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 15.08
ACD/KOC (pH 7.4): 214.38
Polar Surface Area: 136 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 57.1±7.0 dyne/cm
Molar Volume: 321.8±7.0 cm3

Click to predict properties on the Chemicalize site


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