ChemSpider 2D Image | 2-[2-(Aminomethyl)phenyl]-N-[5-(4-{6-[(phenylacetyl)amino]-3-pyridazinyl}butyl)-1,3,4-thiadiazol-2-yl]acetamide | C27H29N7O2S

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

  • Molecular FormulaC27H29N7O2S
  • Average mass515.630 Da
  • Monoisotopic mass515.210327 Da
  • ChemSpider ID34959449

More details:

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

2-[2-(Aminométhyl)phényl]-N-[5-(4-{6-[(2-phénylacétyl)amino]-3-pyridazinyl}butyl)-1,3,4-thiadiazol-2-yl]acétamide [French] [ACD/IUPAC Name]
2-[2-(Aminomethyl)phenyl]-N-[5-(4-{6-[(phenylacetyl)amino]-3-pyridazinyl}butyl)-1,3,4-thiadiazol-2-yl]acetamid [German] [ACD/IUPAC Name]
2-[2-(Aminomethyl)phenyl]-N-[5-(4-{6-[(phenylacetyl)amino]-3-pyridazinyl}butyl)-1,3,4-thiadiazol-2-yl]acetamide [ACD/IUPAC Name]
Benzeneacetamide, 2-(aminomethyl)-N-[5-[4-[6-[(2-phenylacetyl)amino]-3-pyridazinyl]butyl]-1,3,4-thiadiazol-2-yl]- [ACD/Index Name]
US8604016, 685

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: 1.683
Molar Refractivity: 146.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 2.19
ACD/LogD (pH 5.5): -0.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 2.18
ACD/KOC (pH 7.4): 22.54
Polar Surface Area: 164 Å2
Polarizability: 58.0±0.5 10-24cm3
Surface Tension: 69.2±3.0 dyne/cm
Molar Volume: 385.9±3.0 cm3

Click to predict properties on the Chemicalize site


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