basic_info |
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Product_Name: | 1-(3-(4-AMINO-3-(4-PHENYLOXYPHENYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-1-YL)PIPERIDIN-1-YL)PROP-2-EN-1-ONE |
CAS: | 936563-87-0 |
EnglishSynonyms: | 1-(3-(4-AMINO-3-(4-PHENYLOXYPHENYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-1-YL)PIPERIDIN-1-YL)PROP-2-EN-1-ONE |
pro_mdlNumber: | MFCD12032093 |
pro_acceptors: | 8 |
pro_donors: | 1 |
pro_smile: | C=CC(=O)N1CCCC(C1)n2c3c(c(n2)c4ccc(cc4)Oc5ccccc5)c(ncn3)N |
InChi: | InChI=1S/C25H24N6O2/c1-2-21(32)30-14-6-7-18(15-30)31-25-22(24(26)27-16-28-25)23(29-31)17-10-12-20(13-11-17)33-19-8-4-3-5-9-19/h2-5,8-13,16,18H,1,6-7,14-15H2,(H2,26,27,28) |
InChiKey: | InChIKey=XYFPWWZEPKGCCK-UHFFFAOYSA-N |
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