ChemSpider 2D Image | (10S)-10-Isopropyl-14-[(2-isopropyl-6-oxo-1,6-dihydro-3-pyridinyl)carbonyl]-23-methoxy-7-methyl-2-oxa-5,6,8,11,14,18-hexaazatricyclo[18.3.1.0~5,9~]tetracosa-1(24),6,8,20,22-pentaene-12,19-dione | C31H41N7O6

(10S)-10-Isopropyl-14-[(2-isopropyl-6-oxo-1,6-dihydro-3-pyridinyl)carbonyl]-23-methoxy-7-methyl-2-oxa-5,6,8,11,14,18-hexaazatricyclo[18.3.1.05,9]tetracosa-1(24),6,8,20,22-pentaene-12,19-dione

  • Molecular FormulaC31H41N7O6
  • Average mass607.701 Da
  • Monoisotopic mass607.311829 Da
  • ChemSpider ID114951076

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(10S)-10-Isopropyl-14-[(2-isopropyl-6-oxo-1,6-dihydro-3-pyridinyl)carbonyl]-23-methoxy-7-methyl-2-oxa-5,6,8,11,14,18-hexaazatricyclo[18.3.1.05,9]tetracosa-1(24),6,8,20,22-pentaen-12,19-dion [German] [ACD/IUPAC Name]
(10S)-10-Isopropyl-14-[(2-isopropyl-6-oxo-1,6-dihydro-3-pyridinyl)carbonyl]-23-methoxy-7-methyl-2-oxa-5,6,8,11,14,18-hexaazatricyclo[18.3.1.05,9]tetracosa-1(24),6,8,20,22-pentaene-12,19-dione [ACD/IUPAC Name]
(10S)-10-Isopropyl-14-[(2-isopropyl-6-oxo-1,6-dihydro-3-pyridinyl)carbonyl]-23-méthoxy-7-méthyl-2-oxa-5,6,8,11,14,18-hexaazatricyclo[18.3.1.05,9]tétracosa-1(24),6,8,20,22-pentaène-12,19-dione [French] [ACD/IUPAC Name]
12,8-Metheno-8H-[1,2,4]triazolo[1,5-d][1,4,7,10,14]oxatetraazacycloeicosine-13,20-dione, 18-[[1,6-dihydro-2-(1-methylethyl)-6-oxo-3-pyridinyl]carbonyl]-5,6,14,15,16,17,18,19,21,22-decahydro-9-methoxy- 2-methyl-22-(1-methylethyl)-, (22S)- [ACD/Index Name]

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: 1.632
Molar Refractivity: 163.5±0.5 cm3
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -1.19
ACD/LogD (pH 5.5): -0.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.83
ACD/LogD (pH 7.4): -0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.86
Polar Surface Area: 157 Å2
Polarizability: 64.8±0.5 10-24cm3
Surface Tension: 49.3±7.0 dyne/cm
Molar Volume: 458.5±7.0 cm3

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