CAS: | 737789-87-6 |
MF: | C29H27F2N7O5S |
MW: | 623.63 |
EINECS: | 237-099-7 |
Product Categories: | API;737789-87-6 |
Mol File: | 737789-87-6.mol |
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Relugolix Chemical Properties |
Melting point | 228 °C (decomp)(Solv: ethyl acetate (141-78-6); tetrahydrofuran (109-99-9)) |
density | 1.442±0.06 g/cm3(Predicted) |
storage temp. | Store at -20°C |
solubility | DMSO:20.0(Max Conc. mg/mL);32.1(Max Conc. mM) Ethanol:1.0(Max Conc. mg/mL);1.6(Max Conc. mM) |
form | A crystalline solid |
pka | 13.17±0.70(Predicted) |
InChIKey | AOMXMOCNKJTRQP-UHFFFAOYSA-N |
SMILES | N(C1=CC=C(C2SC3=C(C=2CN(C)C)C(=O)N(C2=NN=C(OC)C=C2)C(=O)N3CC2=C(F)C=CC=C2F)C=C1)C(NOC)=O |
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