ChemSpider 2D Image | (12R)-12-Isopropyl-22-methoxy-16-[(8-methylimidazo[1,2-a]pyridin-3-yl)acetyl]-20-oxa-3,6,10,13,16-pentaazatricyclo[19.3.1.0~2,6~]pentacosa-1(25),2,4,21,23-pentaene-11,14-dione | C33H41N7O5

(12R)-12-Isopropyl-22-methoxy-16-[(8-methylimidazo[1,2-a]pyridin-3-yl)acetyl]-20-oxa-3,6,10,13,16-pentaazatricyclo[19.3.1.02,6]pentacosa-1(25),2,4,21,23-pentaene-11,14-dione

  • Molecular FormulaC33H41N7O5
  • Average mass615.722 Da
  • Monoisotopic mass615.316895 Da
  • ChemSpider ID114826017

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(12R)-12-Isopropyl-22-methoxy-16-[(8-methylimidazo[1,2-a]pyridin-3-yl)acetyl]-20-oxa-3,6,10,13,16-pentaazatricyclo[19.3.1.02,6]pentacosa-1(25),2,4,21,23-pentaen-11,14-dion [German] [ACD/IUPAC Name]
(12R)-12-Isopropyl-22-methoxy-16-[(8-methylimidazo[1,2-a]pyridin-3-yl)acetyl]-20-oxa-3,6,10,13,16-pentaazatricyclo[19.3.1.02,6]pentacosa-1(25),2,4,21,23-pentaene-11,14-dione [ACD/IUPAC Name]
(12R)-12-Isopropyl-22-méthoxy-16-[2-(8-méthylimidazo[1,2-a]pyridin-3-yl)acétyl]-20-oxa-3,6,10,13,16-pentaazatricyclo[19.3.1.02,6]pentacosa-1(25),2,4,21,23-pentaène-11,14-dione [French] [ACD/IUPAC Name]
19,23-Metheno-5H,23H-imidazo[1,2-o][1,5,8,11,15]oxatetraazacycloheneicosine-9,12(6H,13H)-dione, 7,8,10,11,14,15,16,17-octahydro-20-methoxy-10-(1-methylethyl)-14-[2-(8-methylimidazo[1,2-a]pyridin-3-yl) acetyl]-, (10R)- [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: 1.641
Molar Refractivity: 170.6±0.5 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 1.74
ACD/LogD (pH 5.5): -0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.92
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 11.39
ACD/KOC (pH 7.4): 183.08
Polar Surface Area: 132 Å2
Polarizability: 67.6±0.5 10-24cm3
Surface Tension: 50.7±7.0 dyne/cm
Molar Volume: 472.7±7.0 cm3

Click to predict properties on the Chemicalize site


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