Found 17 results

Search term: MF = 'C_{27}H_{33}N_{3}OS_{2}'
ChemSpider 2D Image | 1-[3-(3-Methyl-1-piperidinyl)propyl]-3-(4-phenoxyphenyl)-1-(2-thienylmethyl)thiourea | C27H33N3OS2

1-[3-(3-Methyl-1-piperidinyl)propyl]-3-(4-phenoxyphenyl)-1-(2-thienylmethyl)thiourea

  • Molecular FormulaC27H33N3OS2
  • Average mass479.700 Da
  • Monoisotopic mass479.206512 Da
  • ChemSpider ID22467673

More details:

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

1-[3-(3-Methyl-1-piperidinyl)propyl]-3-(4-phenoxyphenyl)-1-(2-thienylmethyl)thioharnstoff [German] [ACD/IUPAC Name]
1-[3-(3-Methyl-1-piperidinyl)propyl]-3-(4-phenoxyphenyl)-1-(2-thienylmethyl)thiourea [ACD/IUPAC Name]
1-[3-(3-Méthyl-1-pipéridinyl)propyl]-3-(4-phénoxyphényl)-1-(2-thiénylméthyl)thiourée [French] [ACD/IUPAC Name]
Thiourea, N-[3-(3-methyl-1-piperidinyl)propyl]-N'-(4-phenoxyphenyl)-N-(2-thienylmethyl)- [ACD/Index Name]
3-[3-(3-METHYLPIPERIDIN-1-YL)PROPYL]-1-(4-PHENOXYPHENYL)-3-(THIOPHEN-2-YLMETHYL)THIOUREA
3-[3-(3-METHYLPIPERIDIN-1-YL)PROPYL]-1-(4-PHENOXYPHENYL)-3-[(THIOPHEN-2-YL)METHYL]THIOUREA

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

Density: 1.2±0.1 g/cm3
Boiling Point: 597.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.9±3.0 kJ/mol
Flash Point: 314.9±32.9 °C
Index of Refraction: 1.637
Molar Refractivity: 144.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 6.64
ACD/LogD (pH 5.5): 3.07
ACD/BCF (pH 5.5): 24.28
ACD/KOC (pH 5.5): 47.87
ACD/LogD (pH 7.4): 4.29
ACD/BCF (pH 7.4): 403.73
ACD/KOC (pH 7.4): 795.95
Polar Surface Area: 88 Å2
Polarizability: 57.1±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 401.5±3.0 cm3

Click to predict properties on the Chemicalize site


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