ChemSpider 2D Image | 2-(Carbamoylamino)-5-phenyl-N-[(3R)-3-piperidinyl]-3-thiophenecarboxamide | C17H20N4O2S

2-(Carbamoylamino)-5-phenyl-N-[(3R)-3-piperidinyl]-3-thiophenecarboxamide

  • Molecular FormulaC17H20N4O2S
  • Average mass344.431 Da
  • Monoisotopic mass344.130707 Da
  • ChemSpider ID23328773

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-(Carbamoylamino)-5-phenyl-N-[(3R)-3-piperidinyl]-3-thiophencarboxamid [German] [ACD/IUPAC Name]
2-(Carbamoylamino)-5-phenyl-N-[(3R)-3-piperidinyl]-3-thiophenecarboxamide [ACD/IUPAC Name]
2-(Carbamoylamino)-5-phényl-N-[(3R)-3-pipéridinyl]-3-thiophènecarboxamide [French] [ACD/IUPAC Name]
3-Thiophenecarboxamide, 2-[(aminocarbonyl)amino]-5-phenyl-N-[(3R)-3-piperidinyl]- [ACD/Index Name]
(R)-1-(5-phenyl-3-(piperidin-3-ylcarbamoyl)thiophen-2-yl)urea
2-(carbamoylamino)-5-phenyl-N-[(3R)-piperidin-3-yl]thiophene-3-carboxamide
CHEMBL519226
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL519226/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 546.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.6±3.0 kJ/mol
Flash Point: 284.5±30.1 °C
Index of Refraction: 1.661
Molar Refractivity: 94.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 3.16
ACD/LogD (pH 5.5): -0.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.71
Polar Surface Area: 124 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 66.8±5.0 dyne/cm
Molar Volume: 256.3±5.0 cm3

Click to predict properties on the Chemicalize site


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