Found 8 results

Search term: MF = 'C_{21}H_{28}N_{6}O_{7}S_{2}'
ChemSpider 2D Image | N-(2-Methoxy-5-nitrophenyl)-2-{6-methyl-5-[(4-methyl-1-piperazinyl)sulfonyl]-4-oxo-4a,5,6,7a-tetrahydrothieno[2,3-d]pyrimidin-3(4H)-yl}acetamide | C21H28N6O7S2

N-(2-Methoxy-5-nitrophenyl)-2-{6-methyl-5-[(4-methyl-1-piperazinyl)sulfonyl]-4-oxo-4a,5,6,7a-tetrahydrothieno[2,3-d]pyrimidin-3(4H)-yl}acetamide

  • Molecular FormulaC21H28N6O7S2
  • Average mass540.613 Da
  • Monoisotopic mass540.146057 Da
  • ChemSpider ID113637375

More details:

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

N-(2-Methoxy-5-nitrophenyl)-2-{6-methyl-5-[(4-methyl-1-piperazinyl)sulfonyl]-4-oxo-4a,5,6,7a-tetrahydrothieno[2,3-d]pyrimidin-3(4H)-yl}acetamid [German] [ACD/IUPAC Name]
N-(2-Methoxy-5-nitrophenyl)-2-{6-methyl-5-[(4-methyl-1-piperazinyl)sulfonyl]-4-oxo-4a,5,6,7a-tetrahydrothieno[2,3-d]pyrimidin-3(4H)-yl}acetamide [ACD/IUPAC Name]
N-(2-Méthoxy-5-nitrophényl)-2-{6-méthyl-5-[(4-méthyl-1-pipérazinyl)sulfonyl]-4-oxo-4a,5,6,7a-tétrahydrothiéno[2,3-d]pyrimidin-3(4H)-yl}acétamide [French] [ACD/IUPAC Name]
Thieno[2,3-d]pyrimidine-3(4H)-acetamide, 4a,5,6,7a-tetrahydro-N-(2-methoxy-5-nitrophenyl)-6-methyl-5-[(4-methyl-1-piperazinyl)sulfonyl]-4-oxo- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.720
Molar Refractivity: 132.9±0.5 cm3
#H bond acceptors: 13
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 0.69
ACD/LogD (pH 5.5): 0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.52
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 2.42
ACD/KOC (pH 7.4): 64.68
Polar Surface Area: 191 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 69.6±7.0 dyne/cm
Molar Volume: 336.5±7.0 cm3

Click to predict properties on the Chemicalize site


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