N-[(3R,6S)-6-(2,3-二氟苯基)六氢-2-氧代-1-(2,2,2-三氟乙基)-1H-氮杂卓-3-基]-4-(2,3-二氢-2-氧代-1H-咪唑并[4,5-b]吡啶-1-基)-1-哌啶甲酰胺

CAS号
781649-09-0
CCD编号
CCD01392567
分子式
C26 H27 F5 N6 O3
分子量
566.528

基本信息

产品名称: N-[(3R,6S)-6-(2,3-二氟苯基)六氢-2-氧代-1-(2,2,2-三氟乙基)-1H-氮杂卓-3-基]-4-(2,3-二氢-2-氧代-1H-咪唑并[4,5-b]吡啶-1-基)-1-哌啶甲酰胺
CAS: 781649-09-0
中文同义词: 1-[4-(1H-苯并咪唑-2-基甲氧基)苯基]-3-(4-氯苯基)硫代脲 ; N-[(3R,6S)-6-(2,3-二氟苯基)六氢-2-氧代-1-(2,2,2-三氟乙基)-1H-氮杂卓-3-基]-4-(2,3-二氢-2-氧代-1H-咪唑并[4,5-b]吡啶-1-基)-1-哌啶甲酰胺
英文同义词: MK-0974 ; 1-PIPERIDINECARBOXAMIDE, N-[(3R,6S)-6-(2,3-DIFLUOROPHENYL)HEXAHYDRO-2-OXO-1-(2,2,2-TRIFLUOROETHYL)-1H-AZEPIN-3-YL]-4-(2,3-DIHYDRO-2-OXO-1H-IMIDAZO[4,5-B]PYRIDIN-1-YL)- ; TELCAGEPANT ; N-[(3R,6S)-6-(2,3-DIFLUOROPHENYL)HEXAHYDRO-2-OXO-1-(2,2,2-TRIFLUOROETHYL)-1H-AZEPIN-3-YL]-4-(2,3-DIH1-PIPERIDINECARBOXAMIDE ; N-[(3R,6S)-6-(2,3-DIFLUOROPHENYL)HEXAHYDRO-2-OXO-1-(2,2,2-TRIFLUOROETHYL)-1H-AZEPIN-3-YL]-4-(2,3-DIHYDRO-2-OXO-1H-IMIDAZO[4,5-B]PYRIDIN-1-YL)-1-PIPERIDINECARBOXAMIDE
MDL号: MFCD11977471
氢键受体数量: 9
氢键供体数量: 2
Smile: c1cc(c(c(c1)F)F)[C@@H]2CC[C@@H](C(=O)N(C2)CC(F)(F)F)C3CC(CCN3C(=O)N)n4c5c(cccn5)[nH]c4=O
InChi: InChI=1S/C26H27F5N6O3/c27-18-4-1-3-16(21(18)28)14-6-7-17(23(38)35(12-14)13-26(29,30)31)20-11-15(8-10-36(20)24(32)39)37-22-19(34-25(37)40)5-2-9-33-22/h1-5,9,14-15,17,20H,6-8,10-13H2,(H2,32,39)(H,34,40)/t14-,15?,17-,20?/m1/s1
InChiKey: InChIKey=IGPJIPJVBAUGIU-IVSQAGSJSA-N

性质

安全信息

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