1252003-15-8

Name Tubastatin-A
CAS 1252003-15-8
Molecular Formula C20H21N3O2
MDL Number MFCD18071463
Molecular Weight 335.4
MOL File 1252003-15-8.mol

Chemical Properties

density  1.28±0.1 g/cm3(Predicted)
storage temp.  Sealed in dry,Store in freezer, under -20°C
solubility  insoluble in EtOH; insoluble in H2O; ≥10.75 mg/mL in DMSO
form  solid
pka 8.95±0.10(Predicted)
color  Off-white to light yellow
InChI InChI=1S/C20H21N3O2/c1-22-11-10-19-17(13-22)16-4-2-3-5-18(16)23(19)12-14-6-8-15(9-7-14)20(24)21-25/h2-9,25H,10-13H2,1H3,(H,21,24)
InChIKey GOVYBPLHWIEHEJ-UHFFFAOYSA-N
SMILES C(NO)(=O)C1=CC=C(CN2C3=C(C=CC=C3)C3CN(C)CCC2=3)C=C1

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