HCID58204322

9-Bromo-2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepine

9-bromo-2-(5-methyl-2-propan-2-yl-1,2,4-triazol-3-yl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine

C17H18BrN5O388.3 g/mol

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IDENTITY

结构与身份

标准 SMILES: Cc1nc(-c2cn3c(n2)-c2ccc(Br)cc2OCC3)n(C(C)C)n1
InChIKey: WLTNPZPMVAIRRH-UHFFFAOYSA-N
分子式: C17H18BrN5O
平均分子量: 388.3 g/mol
单同位素质量: 387.06947

COMPUTED

结构计算性质

已同步

XLogP: 2.9
极性表面积: 57.8 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 2
重原子: 24
形式电荷: 0
复杂度: 453

ALIASES

名称与别名

共 19 条

1282514-63-99-Bromo-2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepineImidazo[1,2-d][1,4]benzoxazepine, 9-bromo-5,6-dihydro-2-[3-methyl-1-(1-methylethyl)-1H-1,2,4-triazol-5-yl]-9-bromo-2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f ]imidazo[1,2-d][1,4]oxazepine9-bromo-2-(5-methyl-2-propan-2-yl-1,2,4-triazol-3-yl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepineMFCD28167891C17H18BrN5OSCHEMBL1485513WLTNPZPMVAIRRH-UHFFFAOYSA-NCS-M2565AKOS027423147SB17834CS-13122DB-208187F53433212-bromo-4-[3-methyl-1-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-9-oxa-3,6-diazatricyclo[8.4.0.02,6]tetradeca1(14),2,4,10,12-pentaene8-Bromo-2-(2-isopropyl-5-methyl-2H-[1,2,4]triazol-3-yl)-4,5-dihydro-6-oxa-1,3a-diaza-benzo[e]azulene8-bromo-2-(2-isopropyl-5-methyl-2H-[1,2,4]triazol-3-yl)-4,5-dihydro-6-oxa-1,3a-diazabenzo[e]azulene9-bromo-2-(2-isopropyl-5-methyl-1,2,4-triazol-3-yl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine

REACTIONS

参与反应

0 条

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