Found 698 results

Search term: MF = 'C_{22}H_{33}N_{5}O_{2}S'
ChemSpider 2D Image | 2-Methoxy-N-(3-methyl-1-{7-[4-(methylsulfanyl)benzyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl}butyl)acetamide | C22H33N5O2S

2-Methoxy-N-(3-methyl-1-{7-[4-(methylsulfanyl)benzyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl}butyl)acetamide

  • Molecular FormulaC22H33N5O2S
  • Average mass431.595 Da
  • Monoisotopic mass431.235504 Da
  • ChemSpider ID22229491

More details:

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

2-Methoxy-N-(3-methyl-1-{7-[4-(methylsulfanyl)benzyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl}butyl)acetamid [German] [ACD/IUPAC Name]
2-Methoxy-N-(3-methyl-1-{7-[4-(methylsulfanyl)benzyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl}butyl)acetamide [ACD/IUPAC Name]
2-Méthoxy-N-(3-méthyl-1-{7-[4-(méthylsulfanyl)benzyl]-6,7,8,9-tétrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazépin-3-yl}butyl)acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-methoxy-N-[3-methyl-1-[6,7,8,9-tetrahydro-7-[[4-(methylthio)phenyl]methyl]-5H-1,2,4-triazolo[4,3-d][1,4]diazepin-3-yl]butyl]- [ACD/Index Name]
2-methoxy-N-(3-methyl-1-{7-[4-(methylthio)benzyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl}butyl)acetamide

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.615
Molar Refractivity: 122.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.33
ACD/LogD (pH 5.5): 1.29
ACD/BCF (pH 5.5): 2.82
ACD/KOC (pH 5.5): 32.19
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 41.40
ACD/KOC (pH 7.4): 473.21
Polar Surface Area: 98 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 45.2±7.0 dyne/cm
Molar Volume: 351.5±7.0 cm3

Click to predict properties on the Chemicalize site


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