2S)-1-[3-乙基-7-[[(1-氧代-3-吡啶基)甲基]氨基]吡唑并[1,5-a]嘧啶-5-基]-2-哌啶乙醇

CAS号
779353-01-4
CCD编号
CCD02499210
分子式
C21 H28 N6 O2
分子量
396.492

基本信息

产品名称: 2S)-1-[3-乙基-7-[[(1-氧代-3-吡啶基)甲基]氨基]吡唑并[1,5-a]嘧啶-5-基]-2-哌啶乙醇
CAS: 779353-01-4
中文同义词: 2S)-1-[3-乙基-7-[[(1-氧代-3-吡啶基)甲基]氨基]吡唑并[1,5-a]嘧啶-5-基]-2-哌啶乙醇
英文同义词: DINACICLIB ; 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 ; 2-PIPERIDINEETHANOL, 1-[3-ETHYL-7-[[(1-OXIDO-3-PYRIDINYL)METHYL]AMINO]PYRAZOLO[1,5-A]PYRIMIDIN-5-YL]-, (2S)- ; (S)-3-(((3-ETHYL-5-(2-(2-HYDROXYETHYL)PIPERIDIN-1-YL)PYRAZOLO[1,5-A]PYRIMIDIN-7-YL)AMINO)METHYL)PYRIDINE 1-OXIDE ; DINACICLIB (SCH727965)
MDL号: MFCD16037702
氢键受体数量: 8
氢键供体数量: 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

性质

安全信息

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