ChemSpider 2D Image | 3-Amino-5-(benzylamino)-N-carbamimidoyl-6-chloro-2-pyrazinecarboxamide | C13H14ClN7O

3-Amino-5-(benzylamino)-N-carbamimidoyl-6-chloro-2-pyrazinecarboxamide

  • Molecular FormulaC13H14ClN7O
  • Average mass319.750 Da
  • Monoisotopic mass319.094849 Da
  • ChemSpider ID28498169

More details:

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

2-Pyrazinecarboxamide, 3-amino-N-(aminoiminomethyl)-6-chloro-5-[(phenylmethyl)amino]- [ACD/Index Name]
3-Amino-5-(benzylamino)-N-carbamimidoyl-6-chlor-2-pyrazincarboxamid [German] [ACD/IUPAC Name]
3-Amino-5-(benzylamino)-N-carbamimidoyl-6-chloro-2-pyrazinecarboxamide [ACD/IUPAC Name]
3-Amino-5-(benzylamino)-N-carbamimidoyl-6-chloro-2-pyrazinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.738
Molar Refractivity: 80.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 0.76
ACD/LogD (pH 5.5): 0.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 23.30
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 2.20
ACD/KOC (pH 7.4): 55.10
Polar Surface Area: 143 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 70.6±7.0 dyne/cm
Molar Volume: 200.7±7.0 cm3

Click to predict properties on the Chemicalize site


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