ChemSpider 2D Image | (7S)-7-(1H-Indol-3-ylmethyl)-21-methoxy-19-oxa-5,8,10,16-tetraazatricyclo[18.3.1.1~8,11~]pentacosa-1(24),20,22-triene-6,9,17,25-tetrone | C30H35N5O6

(7S)-7-(1H-Indol-3-ylmethyl)-21-methoxy-19-oxa-5,8,10,16-tetraazatricyclo[18.3.1.18,11]pentacosa-1(24),20,22-triene-6,9,17,25-tetrone

  • Molecular FormulaC30H35N5O6
  • Average mass561.629 Da
  • Monoisotopic mass561.258728 Da
  • ChemSpider ID71341707

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(7S)-7-(1H-Indol-3-ylmethyl)-21-methoxy-19-oxa-5,8,10,16-tetraazatricyclo[18.3.1.18,11]pentacosa-1(24),20,22-trien-6,9,17,25-tetron [German] [ACD/IUPAC Name]
(7S)-7-(1H-Indol-3-ylmethyl)-21-methoxy-19-oxa-5,8,10,16-tetraazatricyclo[18.3.1.18,11]pentacosa-1(24),20,22-triene-6,9,17,25-tetrone [ACD/IUPAC Name]
(7S)-7-(1H-Indol-3-ylméthyl)-21-méthoxy-19-oxa-5,8,10,16-tétraazatricyclo[18.3.1.18,11]pentacosa-1(24),20,22-triène-6,9,17,25-tétrone [French] [ACD/IUPAC Name]
19-Oxa-5,8,10,16-tetraazatricyclo[18.3.1.18,11]pentacosa-1(24),20,22-triene-6,9,17,25-tetrone, 7-(1H-indol-3-ylmethyl)-21-methoxy-, (7S)- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.654
Molar Refractivity: 151.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 0.47
ACD/LogD (pH 5.5): 1.35
ACD/BCF (pH 5.5): 6.26
ACD/KOC (pH 5.5): 129.35
ACD/LogD (pH 7.4): 1.35
ACD/BCF (pH 7.4): 6.26
ACD/KOC (pH 7.4): 129.29
Polar Surface Area: 142 Å2
Polarizability: 60.1±0.5 10-24cm3
Surface Tension: 68.5±5.0 dyne/cm
Molar Volume: 413.8±5.0 cm3

Click to predict properties on the Chemicalize site


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