ChemSpider 2D Image | GSK-1838705A | C27H27FN8O3

GSK-1838705A

  • Molecular FormulaC27H27FN8O3
  • Average mass530.554 Da
  • Monoisotopic mass530.218994 Da
  • ChemSpider ID25056986

More details:






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

1186659-59-5 [RN]
2-[(2-{[1-(N,N-Dimethylglycyl)-5-methoxy-1H-indol-6-yl]amino}-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-6-fluor-N-methylbenzamid [German] [ACD/IUPAC Name]
2-[(2-{[1-(N,N-Dimethylglycyl)-5-methoxy-1H-indol-6-yl]amino}-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-6-fluoro-N-methylbenzamide [ACD/IUPAC Name]
2-[(2-{[1-(N,N-Diméthylglycyl)-5-méthoxy-1H-indol-6-yl]amino}-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-6-fluoro-N-méthylbenzamide [French] [ACD/IUPAC Name]
Benzamide, 2-[[2-[[1-[2-(dimethylamino)acetyl]-5-methoxy-1H-indol-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-6-fluoro-N-methyl- [ACD/Index Name]
GSK-1838705A
2-?[[2-?[[1-?[2-?(dimethylamino)?acetyl]?-?5-?methoxy-?1H-?indol-?6-?yl]?amino]?-?7H-?pyrrolo[2,?3-?d]?pyrimidin-?4-?yl]?amino]?-?6-?fluoro-?N-?methyl-Benzamide
2-[[2-[[1-[2-(dimethylamino)acetyl]-5-methoxyindol-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-6-fluoro-N-methylbenzamide
GS2

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

W6545R69M8 [DBID]
UNII:W6545R69M8 [DBID]
UNII-W6545R69M8 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.688
Molar Refractivity: 142.7±0.5 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 1.83
ACD/LogD (pH 5.5): 0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.99
ACD/LogD (pH 7.4): 2.80
ACD/BCF (pH 7.4): 71.46
ACD/KOC (pH 7.4): 654.25
Polar Surface Area: 129 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 53.1±7.0 dyne/cm
Molar Volume: 374.3±7.0 cm3

Click to predict properties on the Chemicalize site






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