ChemSpider 2D Image | 1,11-Dichloro-6-[2-(diethylamino)ethyl]-12-(4-O-methylhexopyranosyl)-12,13-dihydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione | C33H34Cl2N4O7

1,11-Dichloro-6-[2-(diethylamino)ethyl]-12-(4-O-methylhexopyranosyl)-12,13-dihydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione

  • Molecular FormulaC33H34Cl2N4O7
  • Average mass669.552 Da
  • Monoisotopic mass668.180481 Da
  • ChemSpider ID327470

More details:

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

1,11-Dichlor-6-[2-(diethylamino)ethyl]-12-(4-O-methylhexopyranosyl)-12,13-dihydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5,7(6H)-dion [German] [ACD/IUPAC Name]
1,11-Dichloro-6-[2-(diethylamino)ethyl]-12-(4-O-methylhexopyranosyl)-12,13-dihydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione [ACD/IUPAC Name]
1,11-Dichloro-6-[2-(diéthylamino)éthyl]-12-(4-O-méthylhexopyranosyl)-12,13-dihydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione [French] [ACD/IUPAC Name]
5H-Indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione, 1,11-dichloro-6-[2-(diethylamino)ethyl]-12,13-dihydro-12-(4-O-methylhexopyranosyl)- [ACD/Index Name]
119673-08-4 [RN]
5H-Indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione, 1,11-β-D-glucopyranosyl)-
6 N-Diethylaminoethyl rebeccamycin
Becatecarin [USAN]
Rebeccamycin analog

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

BMS-181176 [DBID]
Bmy 27557 [DBID]
NCI60_013377 [DBID]
NSC640199 [DBID]
NSC655649 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point: 848.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 129.3±3.0 kJ/mol
Flash Point: 467.2±34.3 °C
Index of Refraction: 1.739
Molar Refractivity: 167.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 7.17
ACD/LogD (pH 5.5): 2.50
ACD/BCF (pH 5.5): 8.61
ACD/KOC (pH 5.5): 21.82
ACD/LogD (pH 7.4): 3.31
ACD/BCF (pH 7.4): 55.58
ACD/KOC (pH 7.4): 140.82
Polar Surface Area: 140 Å2
Polarizability: 66.4±0.5 10-24cm3
Surface Tension: 62.7±7.0 dyne/cm
Molar Volume: 415.5±7.0 cm3

Click to predict properties on the Chemicalize site


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