2113650-03-4

Name BMS-1001
CAS 2113650-03-4
Molecular Formula C35H34N2O7
MDL Number MFCD32709962
Molecular Weight 594.65
MOL File 2113650-03-4.mol

Chemical Properties

Boiling point  801.2±65.0 °C(Predicted)
density  1.34±0.1 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  DMSO: 50 mg/mL (84.08 mM);Ethanol: Insoluble
pka 2.08±0.10(Predicted)
Water Solubility  Water: Insoluble
InChIKey UWNXGZKSIKQKAH-SSEXGKCCSA-N
SMILES C(O)(=O)[C@@H](CO)NCC1=CC(C)=C(OCC2=CC=CC(C3=CC=C4OCCOC4=C3)=C2C)C=C1OCC1=CC=CC(C#N)=C1

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