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Search term: DIZGFRSKRZZKAK-UHFFFAOYSA-O (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-[4-(5-{[4-{[4-(Acetamidomethyl)-1-piperidinyl]methyl}-6-(3,5-dichlorophenyl)-2-pyridinyl]oxy}-2-pyrimidinyl)-1-piperazinyl]propanoic acid | C31H37Cl2N7O4

3-[4-(5-{[4-{[4-(Acetamidomethyl)-1-piperidinyl]methyl}-6-(3,5-dichlorophenyl)-2-pyridinyl]oxy}-2-pyrimidinyl)-1-piperazinyl]propanoic acid

  • Molecular FormulaC31H37Cl2N7O4
  • Average mass642.576 Da
  • Monoisotopic mass641.228394 Da
  • ChemSpider ID129267147

More details:

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

1-Piperazinepropanoic acid, 4-[5-[[4-[[4-[(acetylamino)methyl]-1-piperidinyl]methyl]-6-(3,5-dichlorophenyl)-2-pyridinyl]oxy]-2-pyrimidinyl]- [ACD/Index Name]
3-[4-(5-{[4-{[4-(Acetamidomethyl)-1-piperidinyl]methyl}-6-(3,5-dichlorophenyl)-2-pyridinyl]oxy}-2-pyrimidinyl)-1-piperazinyl]propanoic acid [ACD/IUPAC Name]
3-[4-(5-{[4-{[4-(Acetamidomethyl)-1-piperidinyl]methyl}-6-(3,5-dichlorphenyl)-2-pyridinyl]oxy}-2-pyrimidinyl)-1-piperazinyl]propansäure [German] [ACD/IUPAC Name]
Acide 3-[4-(5-{[4-{[4-(acétamidométhyl)-1-pipéridinyl]méthyl}-6-(3,5-dichlorophényl)-2-pyridinyl]oxy}-2-pyrimidinyl)-1-pipérazinyl]propanoïque [French] [ACD/IUPAC Name]

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: 1.605
Molar Refractivity: 167.8±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.55
ACD/LogD (pH 5.5): 0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.30
Polar Surface Area: 124 Å2
Polarizability: 66.5±0.5 10-24cm3
Surface Tension: 57.5±3.0 dyne/cm
Molar Volume: 487.3±3.0 cm3

Click to predict properties on the Chemicalize site


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