Basic Information |
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Product Name: | DINACICLIB |
CAS: | 779353-01-4 |
English Synonyms: | (S)-3-(((3-ETHYL-5-(2-(2-HYDROXYETHYL)PIPERIDIN-1-YL)PYRAZOLO[1,5-A]PYRIMIDIN-7-YL)AMINO)METHYL)PYRIDINE 1-OXIDE ; 2-PIPERIDINEETHANOL, 1-[3-ETHYL-7-[[(1-OXIDO-3-PYRIDINYL)METHYL]AMINO]PYRAZOLO[1,5-A]PYRIMIDIN-5-YL]-, (2S)- ; 3-[((3-ETHYL-5-[(2S)-2-(2-HYDROXYETHYL)PIPERIDIN-1-YL]PYRAZOLO[1,5-A]PYRIMIDIN-7-YL)AMINO)METHYL]PYRIDIN-1-IUM-1-OLATE ; DINACICLIB ; DINACICLIB (SCH727965) |
MDL Number.: | MFCD16037702 |
H bond acceptor: | 8 |
H bond donor: | 2 |
Smile: | CCc1cnn2c1nc(cc2NCc3ccc[n+](c3)[O-])N4CCCC[C@H]4CCO |
InChi: | InChI=1S/C21H28N6O2/c1-2-17-14-23-27-19(22-13-16-6-5-9-25(29)15-16)12-20(24-21(17)27)26-10-4-3-7-18(26)8-11-28/h5-6,9,12,14-15,18,22,28H,2-4,7-8,10-11,13H2,1H3/t18-/m0/s1 |
InChiKey: | InChIKey=PIMQWRZWLQKKBJ-SFHVURJKSA-N |
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