Found 116 results

Search term: MF = 'C_{27}H_{25}Cl_{2}N_{3}O_{3}S'
ChemSpider 2D Image | N-Benzyl-2-[3-(3,4-dichlorophenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-ethylacetamide | C27H25Cl2N3O3S

N-Benzyl-2-[3-(3,4-dichlorophenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-ethylacetamide

  • Molecular FormulaC27H25Cl2N3O3S
  • Average mass542.477 Da
  • Monoisotopic mass541.099365 Da
  • ChemSpider ID20242198

More details:

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

[1]Benzothieno[2,3-d]pyrimidine-1(2H)-acetamide, 3-(3,4-dichlorophenyl)-N-ethyl-3,4,5,6,7,8-hexahydro-2,4-dioxo-N-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-2-[3-(3,4-dichlorophenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-ethylacetamide [ACD/IUPAC Name]
N-Benzyl-2-[3-(3,4-dichlorophényl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothiéno[2,3-d]pyrimidin-1(2H)-yl]-N-éthylacétamide [French] [ACD/IUPAC Name]
N-Benzyl-2-[3-(3,4-dichlorphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-ethylacetamid [German] [ACD/IUPAC Name]
899915-89-0 [RN]
N-benzyl-2-(3-(3,4-dichlorophenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-1(2H)-yl)-N-ethylacetamide
N-benzyl-2-[4-(3,4-dichlorophenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-6-yl]-N-ethylacetamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 737.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.5±3.0 kJ/mol
Flash Point: 399.5±35.7 °C
Index of Refraction: 1.653
Molar Refractivity: 142.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 5.86
ACD/LogD (pH 5.5): 5.90
ACD/BCF (pH 5.5): 17927.26
ACD/KOC (pH 5.5): 38570.23
ACD/LogD (pH 7.4): 5.90
ACD/BCF (pH 7.4): 17927.28
ACD/KOC (pH 7.4): 38570.27
Polar Surface Area: 89 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 60.4±3.0 dyne/cm
Molar Volume: 387.9±3.0 cm3

Click to predict properties on the Chemicalize site


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