Found 2061 results

Search term: MF = 'C_{15}H_{22}N_{4}O_{4}S'
ChemSpider 2D Image | 4-[(TERT-BUTOXY)CARBONYL]-1-[2-(METHYLSULFANYL)PYRIMIDIN-4-YL]PIPERAZINE-2-CARBOXYLIC ACID | C15H22N4O4S

4-[(TERT-BUTOXY)CARBONYL]-1-[2-(METHYLSULFANYL)PYRIMIDIN-4-YL]PIPERAZINE-2-CARBOXYLIC ACID

  • Molecular FormulaC15H22N4O4S
  • Average mass354.425 Da
  • Monoisotopic mass354.136169 Da
  • ChemSpider ID27458234

More details:

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

1,3-Piperazinedicarboxylic acid, 4-[2-(methylthio)-4-pyrimidinyl]-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
1261229-73-5 [RN]
4-[(TERT-BUTOXY)CARBONYL]-1-[2-(METHYLSULFANYL)PYRIMIDIN-4-YL]PIPERAZINE-2-CARBOXYLIC ACID
4-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1-[2-(methylsulfanyl)-4-pyrimidinyl]-2-piperazincarbonsäure [German] [ACD/IUPAC Name]
4-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1-[2-(methylsulfanyl)-4-pyrimidinyl]-2-piperazinecarboxylic acid [ACD/IUPAC Name]
Acide 4-{[(2-méthyl-2-propanyl)oxy]carbonyl}-1-[2-(méthylsulfanyl)-4-pyrimidinyl]-2-pipérazinecarboxylique [French] [ACD/IUPAC Name]
(1-TERT-BUTYL)-4-(2-METHYLSULFANYL-PYRIMIDIN-4-YL)-PIPERAZINE-1,3-DICARBOXYLIC ACID ESTER
4-(2-methylsulfanylpyrimidin-4-yl)piperazine-1,3-dicarboxylic acid 1-tert-butyl ester
4-(2-methylsulfanyl-pyrimidin-4-yl)piperazine-1,3-dicarboxylic acid 1-tert-butyl ester
4-(2-Methylsulfanyl-pyrimidin-4-yl)-piperazine-1,3-dicarboxylic acid 1-tert-butyl ester
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 549.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.3±3.0 kJ/mol
Flash Point: 286.2±30.1 °C
Index of Refraction: 1.607
Molar Refractivity: 90.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.51
ACD/LogD (pH 5.5): -1.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 121 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 67.3±5.0 dyne/cm
Molar Volume: 262.2±5.0 cm3

Click to predict properties on the Chemicalize site


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