7-QUINAZOLINECARBOXAMIDE, 3,4-DIHYDRO-N-BUTYL-2-METHYL-3-(2-METHYLPHEN YL)-4-OXO-, HYDROCHLORIDE, HYDRATE (2:2:1)

CAS号
74101-62-5
CCD编号
CCD00250643
分子式
2 C21 H23 N3 O2 . 2 Cl H . H2 O
分子量
789.8

基本信息

产品名称: 7-QUINAZOLINECARBOXAMIDE, 3,4-DIHYDRO-N-BUTYL-2-METHYL-3-(2-METHYLPHEN YL)-4-OXO-, HYDROCHLORIDE, HYDRATE (2:2:1)
CAS: 74101-62-5
英文同义词: 7-QUINAZOLINECARBOXAMIDE, 3,4-DIHYDRO-N-BUTYL-2-METHYL-3-(2-METHYLPHEN YL)-4-OXO-, HYDROCHLORIDE, HYDRATE (2:2:1)
MDL号: MFCD01749890
氢键受体数量: 5
氢键供体数量: 1
Smile: CCCCNC(=O)c1ccc2c(c1)nc(n(c2=O)c3ccccc3C)C.CCCCNC(=O)c1ccc2c(c1)nc(n(c2=O)c3ccccc3C)C.O.Cl.Cl
InChi: InChI=1S/2C21H23N3O2.2ClH.H2O/c2*1-4-5-12-22-20(25)16-10-11-17-18(13-16)23-15(3)24(21(17)26)19-9-7-6-8-14(19)2;;;/h2*6-11,13H,4-5,12H2,1-3H3,(H,22,25);2*1H;1H2
InChiKey: InChIKey=ZXTCUKBHRIHSDC-UHFFFAOYSA-N

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