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5-Pyrimidinecarboxylic acid, 4-amino-6-[1-[(1R)-2-cyano-1-cyclopentylethyl]-1H-pyrazol-4-yl]- Structure

5-Pyrimidinecarboxylic acid, 4-amino-6-[1-[(1R)-2-cyano-1-cyclopentylethyl]-1H-pyrazol-4-yl]-

Chemical Properties

Boiling point 611.8±55.0 °C(Predicted)
Density  1.49±0.1 g/cm3(Predicted)
pka 1.79±0.36(Predicted)
InChI InChI=1S/C16H18N6O2/c17-6-5-12(10-3-1-2-4-10)22-8-11(7-21-22)14-13(16(23)24)15(18)20-9-19-14/h7-10,12H,1-5H2,(H,23,24)(H2,18,19,20)/t12-/m1/s1
InChIKey ZTIPDMQZVFHNCR-GFCCVEGCSA-N
SMILES C1=NC(C2=CN([C@@H](C3CCCC3)CC#N)N=C2)=C(C(O)=O)C(N)=N1

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