Found 361 results

Search term: MF = 'C_{18}H_{33}N_{3}O_{2}S'
ChemSpider 2D Image | 2-(3-Methyl-1-piperidinyl)-1-{4-[(propylsulfanyl)acetyl]-1,4-diazepan-1-yl}ethanone | C18H33N3O2S

2-(3-Methyl-1-piperidinyl)-1-{4-[(propylsulfanyl)acetyl]-1,4-diazepan-1-yl}ethanone

  • Molecular FormulaC18H33N3O2S
  • Average mass355.539 Da
  • Monoisotopic mass355.229340 Da
  • ChemSpider ID71322829

More details:

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

2-(3-Methyl-1-piperidinyl)-1-{4-[(propylsulfanyl)acetyl]-1,4-diazepan-1-yl}ethanon [German] [ACD/IUPAC Name]
2-(3-Methyl-1-piperidinyl)-1-{4-[(propylsulfanyl)acetyl]-1,4-diazepan-1-yl}ethanone [ACD/IUPAC Name]
2-(3-Méthyl-1-pipéridinyl)-1-{4-[2-(propylsulfanyl)acétyl]-1,4-diazépan-1-yl}éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[hexahydro-4-[2-(3-methyl-1-piperidinyl)acetyl]-1H-1,4-diazepin-1-yl]-2-(propylthio)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 526.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.1±3.0 kJ/mol
Flash Point: 272.4±30.1 °C
Index of Refraction: 1.525
Molar Refractivity: 99.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 0.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.48
ACD/LogD (pH 7.4): 2.19
ACD/BCF (pH 7.4): 18.45
ACD/KOC (pH 7.4): 177.46
Polar Surface Area: 69 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 325.8±3.0 cm3

Click to predict properties on the Chemicalize site


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