Found 574 results

Search term: MF = 'C_{28}H_{44}N_{4}O_{4}'
ChemSpider 2D Image | (3R)-18-(Cyclohexylmethyl)-3-propyl-12,15-dioxa-1,4,10,18-tetraazatricyclo[18.2.2.0~6,11~]tetracosa-6,8,10-triene-2,5-dione | C28H44N4O4

(3R)-18-(Cyclohexylmethyl)-3-propyl-12,15-dioxa-1,4,10,18-tetraazatricyclo[18.2.2.06,11]tetracosa-6,8,10-triene-2,5-dione

  • Molecular FormulaC28H44N4O4
  • Average mass500.673 Da
  • Monoisotopic mass500.336243 Da
  • ChemSpider ID84488890

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-18-(Cyclohexylmethyl)-3-propyl-12,15-dioxa-1,4,10,18-tetraazatricyclo[18.2.2.06,11]tetracosa-6,8,10-trien-2,5-dion [German] [ACD/IUPAC Name]
(3R)-18-(Cyclohexylmethyl)-3-propyl-12,15-dioxa-1,4,10,18-tetraazatricyclo[18.2.2.06,11]tetracosa-6,8,10-triene-2,5-dione [ACD/IUPAC Name]
(3R)-18-(Cyclohexylméthyl)-3-propyl-12,15-dioxa-1,4,10,18-tétraazatricyclo[18.2.2.06,11]tétracosa-6,8,10-triène-2,5-dione [French] [ACD/IUPAC Name]
5H-9,12-Ethanopyrido[3,2-q]-1,4,7,12,15-dioxatriazacyclooctadecine-13,16-dione, 7-(cyclohexylmethyl)-2,3,6,7,8,9,10,11,14,15-decahydro-14-propyl-, (14R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 718.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.0±3.0 kJ/mol
Flash Point: 388.2±32.9 °C
Index of Refraction: 1.567
Molar Refractivity: 140.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 0.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.36
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 27.52
ACD/KOC (pH 7.4): 218.73
Polar Surface Area: 84 Å2
Polarizability: 55.5±0.5 10-24cm3
Surface Tension: 53.0±5.0 dyne/cm
Molar Volume: 428.6±5.0 cm3

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