ChemSpider 2D Image | N-(4-Carbamimidoylbenzyl)-2-(3-{[(4-chloro-2-fluorophenyl)sulfonyl]amino}-2-hydroxy-6-methylphenyl)acetamide | C23H22ClFN4O4S

N-(4-Carbamimidoylbenzyl)-2-(3-{[(4-chloro-2-fluorophenyl)sulfonyl]amino}-2-hydroxy-6-methylphenyl)acetamide

  • Molecular FormulaC23H22ClFN4O4S
  • Average mass504.962 Da
  • Monoisotopic mass504.103424 Da
  • ChemSpider ID25040761

More details:






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

Benzeneacetamide, N-[[4-(aminoiminomethyl)phenyl]methyl]-3-[[(4-chloro-2-fluorophenyl)sulfonyl]amino]-2-hydroxy-6-methyl- [ACD/Index Name]
N-(4-Carbamimidoylbenzyl)-2-(3-{[(4-chlor-2-fluorphenyl)sulfonyl]amino}-2-hydroxy-6-methylphenyl)acetamid [German] [ACD/IUPAC Name]
N-(4-Carbamimidoylbenzyl)-2-(3-{[(4-chloro-2-fluorophenyl)sulfonyl]amino}-2-hydroxy-6-methylphenyl)acetamide [ACD/IUPAC Name]
N-(4-Carbamimidoylbenzyl)-2-(3-{[(4-chloro-2-fluorophényl)sulfonyl]amino}-2-hydroxy-6-méthylphényl)acétamide [French] [ACD/IUPAC Name]
CHEMBL541383

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.652
Molar Refractivity: 126.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 0.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.55
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.71
Polar Surface Area: 154 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 55.8±7.0 dyne/cm
Molar Volume: 346.1±7.0 cm3

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