ChemSpider 2D Image | N-(2,3-Dihydro-1H-inden-5-yl)-4-[(9S)-9-isopropyl-19-methoxy-4-methyl-8,11-dioxo-3,17-dioxa-7,10,13,23-tetraazatricyclo[16.3.1.1~2,5~]tricosa-1(22),2(23),4,18,20-pentaen-13-yl]-4-oxobutanamide | C35H43N5O7

N-(2,3-Dihydro-1H-inden-5-yl)-4-[(9S)-9-isopropyl-19-methoxy-4-methyl-8,11-dioxo-3,17-dioxa-7,10,13,23-tetraazatricyclo[16.3.1.12,5]tricosa-1(22),2(23),4,18,20-pentaen-13-yl]-4-oxobutanamide

  • Molecular FormulaC35H43N5O7
  • Average mass645.745 Da
  • Monoisotopic mass645.316223 Da
  • ChemSpider ID76831130

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3,17-Dioxa-7,10,13,23-tetraazatricyclo[16.3.1.12,5]tricosa-1(22),2(23),4,18,20-pentaene-13-butanamide, N-(2,3-dihydro-1H-inden-5-yl)-19-methoxy-4-methyl-9-(1-methylethyl)-γ,8,11-trioxo-, (9S)- [ACD/Index Name]
N-(2,3-Dihydro-1H-inden-5-yl)-4-[(9S)-9-isopropyl-19-methoxy-4-methyl-8,11-dioxo-3,17-dioxa-7,10,13,23-tetraazatricyclo[16.3.1.12,5]tricosa-1(22),2(23),4,18,20-pentaen-13-yl]-4-oxobutanamid [German] [ACD/IUPAC Name]
N-(2,3-Dihydro-1H-inden-5-yl)-4-[(9S)-9-isopropyl-19-methoxy-4-methyl-8,11-dioxo-3,17-dioxa-7,10,13,23-tetraazatricyclo[16.3.1.12,5]tricosa-1(22),2(23),4,18,20-pentaen-13-yl]-4-oxobutanamide [ACD/IUPAC Name]
N-(2,3-Dihydro-1H-indén-5-yl)-4-[(9S)-9-isopropyl-19-méthoxy-4-méthyl-8,11-dioxo-3,17-dioxa-7,10,13,23-tétraazatricyclo[16.3.1.12,5]tricosa-1(22),2(23),4,18,20-pentaén-13-yl]-4-oxobutanamide [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.565
Molar Refractivity: 173.8±0.3 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 3.00
ACD/BCF (pH 5.5): 112.86
ACD/KOC (pH 5.5): 1025.22
ACD/LogD (pH 7.4): 3.00
ACD/BCF (pH 7.4): 112.87
ACD/KOC (pH 7.4): 1025.27
Polar Surface Area: 152 Å2
Polarizability: 68.9±0.5 10-24cm3
Surface Tension: 47.8±3.0 dyne/cm
Molar Volume: 533.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement