ChemSpider 2D Image | (+)-win 64821 | C40H36N6O4

(+)-win 64821

  • Molecular FormulaC40H36N6O4
  • Average mass664.752 Da
  • Monoisotopic mass664.279785 Da
  • ChemSpider ID139324
  • defined stereocentres - 8 of 8 defined stereocentres


More details:



Featured data source



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

(+)-win 64821
(3S,3'S,5aR,5a'R,10bR,10b'R,11aS,11a'S)-3,3'-Dibenzyl-2,2',3,3',5a,5a',6,6',11,11',11a,11a'-dodecahydro-10b,10b'-bipyrazino[1',2':1,5]pyrrolo[2,3-b]indol-1,1',4,4'-tetron [German] [ACD/IUPAC Name]
(3S,3'S,5aR,5a'R,10bR,10b'R,11aS,11a'S)-3,3'-Dibenzyl-2,2',3,3',5a,5a',6,6',11,11',11a,11a'-dodecahydro-10b,10b'-bipyrazino[1',2':1,5]pyrrolo[2,3-b]indole-1,1',4,4'-tetrone [ACD/IUPAC Name]
(3S,3'S,5aR,5a'R,10bR,10b'R,11aS,11a'S)-3,3'-Dibenzyl-2,2',3,3',5a,5a',6,6',11,11',11a,11a'-dodécahydro-10b,10b'-bipyrazino[1',2':1,5]pyrrolo[2,3-b]indole-1,1',4,4'-tétrone [French] [ACD/IUPAC Name]
[10b,10'b-Bi-10bH-pyrazino[1',2':1,5]pyrrolo[2,3-b]indole]-1,1',4,4'-tetrone, 2,2',3,3',5a,5'a,6,6',11,11',11a,11'a-dodecahydro-3,3'-bis(phenylmethyl)-, (3S,3'S,5aR,5a'R,10bR,10b'R,11aS,11a'S)- [ACD/Index Name]
(3S,5aR,10bR,11aS,3'S,5'R,11'R)-3,3'-Dibenzyl-2,3,5a,6,11,11a,2',3',5'a,6',11',11'a-dodecahydro-[10b,10'b]bi[pyrazino[1',2':1,5]pyrrolo[2,3-b]indolyl]-1,4,1',4'-tetraone
[10B,10'B-BI-10BH-PYRAZINO[1',2':1,5]PYRROLO[2,3-B]INDOLE]-1,1',4,4'-TETRONE,2,2',3,3',5A,5'A,6,6',11,11',11A,11'A-DODECAHYDRO-3,3'-BIS(PHENYLMETHYL)-,(3S,3'S,5AR,5'AR,10BR,10'BR,11AS,11'AS)-
150881-27-9 [RN]
Chaetocin, 2,5:2',5'-dide(epidithio)-3,3'-didemethyl-19,19'-dideoxy-19,19'-diphenyl-, (2α,2'β,5β,5'α)-

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

Win 64821 [DBID]
Win-64821 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.768
Molar Refractivity: 185.4±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 0.84
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 14.36
ACD/KOC (pH 5.5): 234.25
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 14.37
ACD/KOC (pH 7.4): 234.52
Polar Surface Area: 123 Å2
Polarizability: 73.5±0.5 10-24cm3
Surface Tension: 83.7±5.0 dyne/cm
Molar Volume: 447.2±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement