Found 191 results

Search term: MF = 'C_{24}H_{34}N_{6}O_{4}S'
ChemSpider 2D Image | (12R,15S)-12-Isobutyl-15-[2-(methylsulfanyl)ethyl]-2-oxa-5,6,7,10,13,16-hexaazatricyclo[17.2.2.1~5,8~]tetracosa-1(21),6,8(24),19,22-pentaene-11,14,17-trione | C24H34N6O4S

(12R,15S)-12-Isobutyl-15-[2-(methylsulfanyl)ethyl]-2-oxa-5,6,7,10,13,16-hexaazatricyclo[17.2.2.15,8]tetracosa-1(21),6,8(24),19,22-pentaene-11,14,17-trione

  • Molecular FormulaC24H34N6O4S
  • Average mass502.630 Da
  • Monoisotopic mass502.236237 Da
  • ChemSpider ID62721655

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(12R,15S)-12-Isobutyl-15-[2-(methylsulfanyl)ethyl]-2-oxa-5,6,7,10,13,16-hexaazatricyclo[17.2.2.15,8]tetracosa-1(21),6,8(24),19,22-pentaen-11,14,17-trion [German] [ACD/IUPAC Name]
(12R,15S)-12-Isobutyl-15-[2-(methylsulfanyl)ethyl]-2-oxa-5,6,7,10,13,16-hexaazatricyclo[17.2.2.15,8]tetracosa-1(21),6,8(24),19,22-pentaene-11,14,17-trione [ACD/IUPAC Name]
(12R,15S)-12-Isobutyl-15-[2-(méthylsulfanyl)éthyl]-2-oxa-5,6,7,10,13,16-hexaazatricyclo[17.2.2.15,8]tétracosa-1(21),6,8(24),19,22-pentaène-11,14,17-trione [French] [ACD/IUPAC Name]
2-Oxa-5,6,7,10,13,16-hexaazatricyclo[17.2.2.15,8]tetracosa-6,8(24),19,21,22-pentaene-11,14,17-trione, 12-(2-methylpropyl)-15-[2-(methylthio)ethyl]-, (12R,15S)- [ACD/Index Name]
(12R,15S)-12-isobutyl-15-[2-(methylthio)ethyl]-2-oxa-5,6,7,10,13,16-hexaazatricyclo[17.2.2.15,8]tetracosa-1(21),6,8(24),19,22-pentaene-11,14,17-trione

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.640
Molar Refractivity: 135.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 0.53
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 5.38
ACD/KOC (pH 5.5): 116.00
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 5.38
ACD/KOC (pH 7.4): 116.00
Polar Surface Area: 153 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 51.8±7.0 dyne/cm
Molar Volume: 377.5±7.0 cm3

Click to predict properties on the Chemicalize site


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