7-(2-BENZOYLOXY-3-(4-(O-CHLOROBENZYL)-1-PIPERAZINYL)PROPYL)THEOPHYLLIN E

CAS号
19977-11-8
CCD编号
CCD00243124
分子式
C28 H31 Cl N6 O4
分子量
551.044

基本信息

产品名称: 7-(2-BENZOYLOXY-3-(4-(O-CHLOROBENZYL)-1-PIPERAZINYL)PROPYL)THEOPHYLLIN E
CAS: 19977-11-8
英文同义词: 7-(2-BENZOYLOXY-3-(4-(O-CHLOROBENZYL)-1-PIPERAZINYL)PROPYL)THEOPHYLLIN E
MDL号: MFCD01702879
氢键受体数量: 10
氢键供体数量: 0
Smile: Cn1c2c(c(=O)n(c1=O)C)n(cn2)CC(CN3CCN(CC3)Cc4ccccc4Cl)OC(=O)c5ccccc5
InChi: InChI=1S/C28H31ClN6O4/c1-31-25-24(26(36)32(2)28(31)38)35(19-30-25)18-22(39-27(37)20-8-4-3-5-9-20)17-34-14-12-33(13-15-34)16-21-10-6-7-11-23(21)29/h3-11,19,22H,12-18H2,1-2H3
InChiKey: InChIKey=LKSQOKWKUSLPLT-UHFFFAOYSA-N

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