3(2H)-哒嗪酮,2-(1H-苯并咪唑-2-基)-4-氯-5-[4-[(六氢-1H-吖庚英-1-基)羰基]-1-哌啶基]-

CAS号
878574-87-9
CCD编号
CCD00627363
分子式
C23 H27 Cl N6 O2
分子量
454.959

基本信息

产品名称: 3(2H)-哒嗪酮,2-(1H-苯并咪唑-2-基)-4-氯-5-[4-[(六氢-1H-吖庚英-1-基)羰基]-1-哌啶基]-
CAS: 878574-87-9
中文同义词: 3(2H)-哒嗪酮,2-(1H-苯并咪唑-2-基)-4-氯-5-[4-[(六氢-1H-吖庚英-1-基)羰基]-1-哌啶基]-
英文同义词: 1H-AZEPINE, 1-[[1-[1-(1H-BENZIMIDAZOL-2-YL)-5-CHLORO-1,6-DIHYDRO-6-OXO-4-PYRIDAZINYL]-4-PIPERIDINYL]CARBONYL]HEXAHYDRO- ; 1-[[1-[1-(1H-BENZIMIDAZOL-2-YL)-5-CHLORO-1,6-DIHYDRO-6-OXO-4-PYRIDAZINYL]-4-PIPERIDINYL]CARBONYL]HEX1H-AZEPINE
MDL号: MFCD08246398
氢键受体数量: 8
氢键供体数量: 1
Smile: c1ccc2c(c1)[nH]c(n2)n3c(=O)c(c(cn3)N4CCC(CC4)C(=O)N5CCCCCC5)Cl
InChi: InChI=1S/C23H27ClN6O2/c24-20-19(15-25-30(22(20)32)23-26-17-7-3-4-8-18(17)27-23)28-13-9-16(10-14-28)21(31)29-11-5-1-2-6-12-29/h3-4,7-8,15-16H,1-2,5-6,9-14H2,(H,26,27)
InChiKey: InChIKey=OTDKQJWKQGEYMS-UHFFFAOYSA-N

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