Found 238 results

Search term: MF = 'C_{27}H_{30}N_{2}O_{4}S_{2}'
ChemSpider 2D Image | {3-[(2,6-Dimethyl-4-morpholinyl)sulfonyl]phenyl}(3-phenyl-5,6,7,8-tetrahydro[1,3]thiazolo[3,2-a]azepin-9-yl)methanone | C27H30N2O4S2

{3-[(2,6-Dimethyl-4-morpholinyl)sulfonyl]phenyl}(3-phenyl-5,6,7,8-tetrahydro[1,3]thiazolo[3,2-a]azepin-9-yl)methanone

  • Molecular FormulaC27H30N2O4S2
  • Average mass510.668 Da
  • Monoisotopic mass510.164703 Da
  • ChemSpider ID3520474

More details:

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

{3-[(2,6-Dimethyl-4-morpholinyl)sulfonyl]phenyl}(3-phenyl-5,6,7,8-tetrahydro[1,3]thiazolo[3,2-a]azepin-9-yl)methanon [German] [ACD/IUPAC Name]
{3-[(2,6-Dimethyl-4-morpholinyl)sulfonyl]phenyl}(3-phenyl-5,6,7,8-tetrahydro[1,3]thiazolo[3,2-a]azepin-9-yl)methanone [ACD/IUPAC Name]
{3-[(2,6-Diméthyl-4-morpholinyl)sulfonyl]phényl}(3-phényl-5,6,7,8-tétrahydro[1,3]thiazolo[3,2-a]azépin-9-yl)méthanone [French] [ACD/IUPAC Name]
Methanone, [3-[(2,6-dimethyl-4-morpholinyl)sulfonyl]phenyl](5,6,7,8-tetrahydro-3-phenylthiazolo[3,2-a]azepin-9-yl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 686.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.6±3.0 kJ/mol
Flash Point: 368.8±34.3 °C
Index of Refraction: 1.675
Molar Refractivity: 140.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.50
ACD/LogD (pH 5.5): 4.42
ACD/BCF (pH 5.5): 1343.41
ACD/KOC (pH 5.5): 6034.79
ACD/LogD (pH 7.4): 4.42
ACD/BCF (pH 7.4): 1344.57
ACD/KOC (pH 7.4): 6040.02
Polar Surface Area: 101 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 64.6±5.0 dyne/cm
Molar Volume: 373.4±5.0 cm3

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