ChemSpider 2D Image | N-[(5R)-5-Amino-6-hydrazino-6-oxohexyl]-5-[(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide (non-preferred name) | C16H30N6O3S

N-[(5R)-5-Amino-6-hydrazino-6-oxohexyl]-5-[(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide (non-preferred name)

  • Molecular FormulaC16H30N6O3S
  • Average mass386.513 Da
  • Monoisotopic mass386.210022 Da
  • ChemSpider ID68026894

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

N-[(5R)-5-Amino-6-hydrazino-6-oxohexyl]-5-[(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamid (non-preferred name) [German] [ACD/IUPAC Name]
N-[(5R)-5-Amino-6-hydrazino-6-oxohexyl]-5-[(3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide (non-preferred name) [ACD/IUPAC Name]
N-[(5R)-5-Amino-6-hydrazino-6-oxohexyl]-5-[(3aR,4R,6aS)-2-oxohexahydro-1H-thiéno[3,4-d]imidazol-4-yl]pentanamide (non-preferred name) [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 806.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 117.2±3.0 kJ/mol
Flash Point: 441.4±34.3 °C
Index of Refraction: 1.553
Molar Refractivity: 101.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 8
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: -2.37
ACD/LogD (pH 5.5): -3.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 177 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 316.7±3.0 cm3

Click to predict properties on the Chemicalize site


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