ChemSpider 2D Image | 2-[3-(Aminomethyl)phenyl]-N-[5-(4-{6-[(ethylcarbamoyl)amino]-3-pyridazinyl}butyl)-1,3,4-thiadiazol-2-yl]acetamide | C22H28N8O2S

2-[3-(Aminomethyl)phenyl]-N-[5-(4-{6-[(ethylcarbamoyl)amino]-3-pyridazinyl}butyl)-1,3,4-thiadiazol-2-yl]acetamide

  • Molecular FormulaC22H28N8O2S
  • Average mass468.575 Da
  • Monoisotopic mass468.205597 Da
  • ChemSpider ID34959404

More details:

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

2-[3-(Aminomethyl)phenyl]-N-[5-(4-{6-[(ethylcarbamoyl)amino]-3-pyridazinyl}butyl)-1,3,4-thiadiazol-2-yl]acetamid [German] [ACD/IUPAC Name]
2-[3-(Aminomethyl)phenyl]-N-[5-(4-{6-[(ethylcarbamoyl)amino]-3-pyridazinyl}butyl)-1,3,4-thiadiazol-2-yl]acetamide [ACD/IUPAC Name]
2-[3-(Aminométhyl)phényl]-N-[5-(4-{6-[(éthylcarbamoyl)amino]-3-pyridazinyl}butyl)-1,3,4-thiadiazol-2-yl]acétamide [French] [ACD/IUPAC Name]
Benzeneacetamide, 3-(aminomethyl)-N-[5-[4-[6-[[(ethylamino)carbonyl]amino]-3-pyridazinyl]butyl]-1,3,4-thiadiazol-2-yl]- [ACD/Index Name]
US8604016, 640

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: 1.664
Molar Refractivity: 130.0±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 1.05
ACD/LogD (pH 5.5): -1.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 176 Å2
Polarizability: 51.5±0.5 10-24cm3
Surface Tension: 68.5±3.0 dyne/cm
Molar Volume: 350.5±3.0 cm3

Click to predict properties on the Chemicalize site


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