1(2H)-PHTHALAZINONE, 4-((4-CHLOROPHENYL)METHYL)-2-(HEXAHYDRO-1-(3-PHEN YLPROPYL)-1H-AZEPIN-4-YL)-, HYDROCHLORIDE, HYDRATE (1:1:1)

CAS号
110406-46-7
CCD编号
CCD00251613
分子式
C30 H32 Cl N3 O . Cl H . H2 O
分子量
540.531

基本信息

产品名称: 1(2H)-PHTHALAZINONE, 4-((4-CHLOROPHENYL)METHYL)-2-(HEXAHYDRO-1-(3-PHEN YLPROPYL)-1H-AZEPIN-4-YL)-, HYDROCHLORIDE, HYDRATE (1:1:1)
CAS: 110406-46-7
英文同义词: 1(2H)-PHTHALAZINONE, 4-((4-CHLOROPHENYL)METHYL)-2-(HEXAHYDRO-1-(3-PHEN YLPROPYL)-1H-AZEPIN-4-YL)-, HYDROCHLORIDE, HYDRATE (1:1:1)
MDL号: MFCD01755786
氢键受体数量: 4
氢键供体数量: 0
Smile: c1ccc(cc1)CCCN2CCCC(CC2)n3c(=O)c4ccccc4c(n3)Cc5ccc(cc5)Cl.O.Cl
InChi: InChI=1S/C30H32ClN3O.ClH.H2O/c31-25-16-14-24(15-17-25)22-29-27-12-4-5-13-28(27)30(35)34(32-29)26-11-7-20-33(21-18-26)19-6-10-23-8-2-1-3-9-23;;/h1-5,8-9,12-17,26H,6-7,10-11,18-22H2;1H;1H2
InChiKey: InChIKey=JIQHZZIHJUDFIO-UHFFFAOYSA-N

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