ChemSpider 2D Image | mozenavir | C33H36N4O3

mozenavir

  • Molecular FormulaC33H36N4O3
  • Average mass536.664 Da
  • Monoisotopic mass536.278748 Da
  • ChemSpider ID135759
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

(4R,5S,6S,7R)-1,3-Bis(3-aminobenzyl)-4,7-dibenzyl-5,6-dihydroxy-1,3-diazepan-2-on [German] [ACD/IUPAC Name]
(4R,5S,6S,7R)-1,3-Bis(3-aminobenzyl)-4,7-dibenzyl-5,6-dihydroxy-1,3-diazepan-2-one [ACD/IUPAC Name]
(4R,5S,6S,7R)-1,3-Bis(3-aminobenzyl)-4,7-dibenzyl-5,6-dihydroxy-1,3-diazépan-2-one [French] [ACD/IUPAC Name]
(4R,5S,6S,7R)-1,3-Bis(3-aminobenzyl)-4,7-dibenzylhexahydro-5,6-dihydroxy-2H-1,3-diazepin-2-one
174391-92-5 [RN]
2H-1,3-Diazepin-2-one, 1,3-bis[(3-aminophenyl)methyl]hexahydro-5,6-dihydroxy-4,7-bis(phenylmethyl)-, (4R,5S,6S,7R)- [ACD/Index Name]
8080
mozenavir [INN]
mozenavir [Spanish] [INN]
mozénavir [French] [INN]
More...

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

64OO8946ER [DBID]
AIDS028412 [DBID]
AIDS-028412 [DBID]
D05538 [DBID]
DMP 450 [DBID]
DMP-450 [DBID]
UNII:64OO8946ER [DBID]
UNII-64OO8946ER [DBID]
XM 412 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 786.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.1±3.0 kJ/mol
Flash Point: 429.7±32.9 °C
Index of Refraction: 1.691
Molar Refractivity: 158.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 5.13
ACD/LogD (pH 5.5): 3.83
ACD/BCF (pH 5.5): 463.49
ACD/KOC (pH 5.5): 2689.78
ACD/LogD (pH 7.4): 3.90
ACD/BCF (pH 7.4): 544.90
ACD/KOC (pH 7.4): 3162.23
Polar Surface Area: 116 Å2
Polarizability: 62.9±0.5 10-24cm3
Surface Tension: 69.3±3.0 dyne/cm
Molar Volume: 414.6±3.0 cm3

Click to predict properties on the Chemicalize site






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