| Identification | Back Directory | [Name]
5-Pyrimidinecarboxylic acid, 4-amino-6-[1-[(1R)-2-cyano-1-cyclopentylethyl]-1H-pyrazol-4-yl]- | [CAS]
2606144-44-7 | [Synonyms]
5-Pyrimidinecarboxylic acid, 4-amino-6-[1-[(1R)-2-cyano-1-cyclopentylethyl]-1H-pyrazol-4-yl]- | [Molecular Formula]
C16H18N6O2 | [MOL File]
2606144-44-7.mol | [Molecular Weight]
326.35 |
| Chemical Properties | Back Directory | [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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