7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-8-(4-METHYL-1-PIPERAZINYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE

CAS号
CCD编号
CCD08103207
分子式
C20 H25 N7 O6
分子量
459.461

基本信息

产品名称: 7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-8-(4-METHYL-1-PIPERAZINYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE
英文同义词: 7-[2-HYDROXY-3-(4-NITROPHENOXY)PROPYL]-3-METHYL-8-(4-METHYL-1-PIPERAZINYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE
MDL号: MFCD01876529
氢键受体数量: 13
氢键供体数量: 2
Smile: Cn1c2c(c(=O)[nH]c1=O)n(c(n2)N3CCN(CC3)C)CC(COc4ccc(cc4)[N+](=O)[O-])O
InChi: InChI=1S/C20H25N7O6/c1-23-7-9-25(10-8-23)19-21-17-16(18(29)22-20(30)24(17)2)26(19)11-14(28)12-33-15-5-3-13(4-6-15)27(31)32/h3-6,14,28H,7-12H2,1-2H3,(H,22,29,30)
InChiKey: InChIKey=IULZFHLSQAAIOL-UHFFFAOYSA-N

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