ChemSpider 2D Image | N~2~-[(4-Methyl-1-piperazinyl)carbonyl]-N-[5-phenyl-1-(phenylsulfonyl)-1-penten-3-yl]argininamide | C29H41N7O4S

N2-[(4-Methyl-1-piperazinyl)carbonyl]-N-[5-phenyl-1-(phenylsulfonyl)-1-penten-3-yl]argininamide

  • Molecular FormulaC29H41N7O4S
  • Average mass583.745 Da
  • Monoisotopic mass583.294067 Da
  • ChemSpider ID26325612

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-Piperazinecarboxamide, N-[4-[(aminoiminomethyl)amino]-1-[[[1-(2-phenylethyl)-3-(phenylsulfonyl)-2-propen-1-yl]amino]carbonyl]butyl]-4-methyl- [ACD/Index Name]
N2-[(4-Methyl-1-piperazinyl)carbonyl]-N-[5-phenyl-1-(phenylsulfonyl)-1-penten-3-yl]argininamid [German] [ACD/IUPAC Name]
N2-[(4-Methyl-1-piperazinyl)carbonyl]-N-[5-phenyl-1-(phenylsulfonyl)-1-penten-3-yl]argininamide [ACD/IUPAC Name]
N2-[(4-Méthyl-1-pipérazinyl)carbonyl]-N-[5-phényl-1-(phénylsulfonyl)-1-pentén-3-yl]argininamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.622
Molar Refractivity: 160.7±0.5 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 1.59
ACD/LogD (pH 5.5): -1.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.14
Polar Surface Area: 169 Å2
Polarizability: 63.7±0.5 10-24cm3
Surface Tension: 53.9±7.0 dyne/cm
Molar Volume: 456.3±7.0 cm3

Click to predict properties on the Chemicalize site


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