8-[(2E)-2-[(Z)-2-BROMO-3-PHENYLPROP-2-ENYLIDENE]HYDRAZINYL]-7-(2-HYDROXY-3-PROPAN-2-YLOXYPROPYL)-3-METHYLPURINE-2,6-DIONE

CAS号
CCD编号
CCD08123714
分子式
C21 H25 Br N6 O4
分子量
505.371

基本信息

产品名称: 8-[(2E)-2-[(Z)-2-BROMO-3-PHENYLPROP-2-ENYLIDENE]HYDRAZINYL]-7-(2-HYDROXY-3-PROPAN-2-YLOXYPROPYL)-3-METHYLPURINE-2,6-DIONE
英文同义词: 8-[(2E)-2-[(Z)-2-BROMO-3-PHENYLPROP-2-ENYLIDENE]HYDRAZINYL]-7-(2-HYDROXY-3-PROPAN-2-YLOXYPROPYL)-3-METHYLPURINE-2,6-DIONE
MDL号: MFCD02049329
氢键受体数量: 10
氢键供体数量: 3
Smile: CC(C)OCC(Cn1c2c(=O)[nH]c(=O)n(c2nc1N/N=C/C(=C/c3ccccc3)/Br)C)O
InChi: InChI=1S/C21H25BrN6O4/c1-13(2)32-12-16(29)11-28-17-18(27(3)21(31)25-19(17)30)24-20(28)26-23-10-15(22)9-14-7-5-4-6-8-14/h4-10,13,16,29H,11-12H2,1-3H3,(H,24,26)(H,25,30,31)/b15-9-,23-10+
InChiKey: InChIKey=CKJYQBGUVAJYCR-CEIQBQCZSA-N

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