ChemSpider 2D Image | N-Benzyl-6-[(4-nitrobenzyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide | C29H21N5O3S

N-Benzyl-6-[(4-nitrobenzyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide

  • Molecular FormulaC29H21N5O3S
  • Average mass519.574 Da
  • Monoisotopic mass519.136536 Da
  • ChemSpider ID3395951

More details:

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

Benzimidazo[1,2-c]quinazoline-3-carboxamide, 6-[[(4-nitrophenyl)methyl]thio]-N-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-6-[(4-nitrobenzyl)sulfanyl]benzimidazo[1,2-c]chinazolin-3-carboxamid [German] [ACD/IUPAC Name]
N-Benzyl-6-[(4-nitrobenzyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide [ACD/IUPAC Name]
N-Benzyl-6-[(4-nitrobenzyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide [French] [ACD/IUPAC Name]
N-benzyl-6-((4-nitrobenzyl)thio)benzo[4,5]imidazo[1,2-c]quinazoline-3-carboxamide
N-benzyl-6-[(4-nitrobenzyl)thio]benzimidazo[1,2-c]quinazoline-3-carboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.735
Molar Refractivity: 148.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.25
ACD/LogD (pH 5.5): 5.55
ACD/BCF (pH 5.5): 9760.53
ACD/KOC (pH 5.5): 24960.05
ACD/LogD (pH 7.4): 5.55
ACD/BCF (pH 7.4): 9761.25
ACD/KOC (pH 7.4): 24961.88
Polar Surface Area: 130 Å2
Polarizability: 58.8±0.5 10-24cm3
Surface Tension: 62.4±7.0 dyne/cm
Molar Volume: 369.7±7.0 cm3

Click to predict properties on the Chemicalize site


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