2435586-30-2

Name 1,2-Cyclopentanediol, 3-[7-[[(1R,2S)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-(propylthio)-3H-1,2,3-triazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)-, (1R,2R,3S,5R)-
CAS 2435586-30-2
Molecular Formula C23H28F2N6O4S
Molecular Weight 522.57
MOL File 2435586-30-2.mol
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Chemical Properties

Boiling point  777.6±70.0 °C(Predicted)
density  1.67±0.1 g/cm3(Predicted)
pka 13.26±0.70(Predicted)
InChIKey OEKWJQXRCDYSHL-UJUAOCSNSA-N
SMILES [C@H]1(O)[C@H](OCCO)C[C@H](N2C3C(N=N2)=C(N[C@@H]2C[C@H]2C2=CC=C(F)C(F)=C2)N=C(SCCC)N=3)[C@H]1O

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