ChemSpider 2D Image | [3-({N-[(1,3,5-Trimethyl-1H-pyrazol-4-yl)sulfonyl]alanyl}amino)-1H-pyrazol-1-yl]acetic acid | C14H20N6O5S

[3-({N-[(1,3,5-Trimethyl-1H-pyrazol-4-yl)sulfonyl]alanyl}amino)-1H-pyrazol-1-yl]acetic acid

  • Molecular FormulaC14H20N6O5S
  • Average mass384.411 Da
  • Monoisotopic mass384.121582 Da
  • ChemSpider ID53702196

More details:

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

[3-({N-[(1,3,5-Trimethyl-1H-pyrazol-4-yl)sulfonyl]alanyl}amino)-1H-pyrazol-1-yl]acetic acid [ACD/IUPAC Name]
[3-({N-[(1,3,5-Trimethyl-1H-pyrazol-4-yl)sulfonyl]alanyl}amino)-1H-pyrazol-1-yl]essigsäure [German] [ACD/IUPAC Name]
1H-Pyrazole-1-acetic acid, 3-[[1-oxo-2-[[(1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl]amino]propyl]amino]- [ACD/Index Name]
Acide [3-({N-[(1,3,5-triméthyl-1H-pyrazol-4-yl)sulfonyl]alanyl}amino)-1H-pyrazol-1-yl]acétique [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.672
Molar Refractivity: 93.7±0.5 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -0.15
ACD/LogD (pH 5.5): -2.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 157 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 61.7±7.0 dyne/cm
Molar Volume: 250.0±7.0 cm3

Click to predict properties on the Chemicalize site


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