Found 9931 results

Search term: MF = 'C_{12}H_{13}N_{3}O_{2}S'
ChemSpider 2D Image | 1-thieno[3,2-d]pyrimidin-4-yl-4-piperidinecarboxylic acid | C12H13N3O2S

1-thieno[3,2-d]pyrimidin-4-yl-4-piperidinecarboxylic acid

  • Molecular FormulaC12H13N3O2S
  • Average mass263.315 Da
  • Monoisotopic mass263.072845 Da
  • ChemSpider ID21472819

More details:

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

1-(Thieno[3,2-d]pyrimidin-4-yl)-4-piperidincarbonsäure [German] [ACD/IUPAC Name]
1-(Thieno[3,2-d]pyrimidin-4-yl)-4-piperidinecarboxylic acid [ACD/IUPAC Name]
1-(Thieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxylic acid
1-thieno[3,2-d]pyrimidin-4-yl-4-piperidinecarboxylic acid
4-Piperidinecarboxylic acid, 1-(thieno[3,2-d]pyrimidin-4-yl)- [ACD/Index Name]
Acide 1-(thiéno[3,2-d]pyrimidin-4-yl)-4-pipéridinecarboxylique [French] [ACD/IUPAC Name]
MFCD09065023 [MDL number]
1-{thieno[3,2-d]pyrimidin-4-yl}piperidine-4-carboxylic acid
1-Thieno[3,2-d]pyrimidin-4-ylpiperidine-4-carboxylic acid
1-thiopheno[2,3-e]pyrimidin-4-ylpiperidine-4-carboxylic acid
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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: 500.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.0±3.0 kJ/mol
Flash Point: 256.7±30.1 °C
Index of Refraction: 1.681
Molar Refractivity: 69.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.15
ACD/LogD (pH 5.5): 0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.81
ACD/LogD (pH 7.4): -1.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 95 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 75.2±3.0 dyne/cm
Molar Volume: 184.0±3.0 cm3

Click to predict properties on the Chemicalize site


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