COC1=CC=CC(=C1OC)C(C2CCN(CC2)CCC3=CC=C(C=C3)F)O
CAS: 139290-65-6
名称: (R)-(2,3-dimethoxyphenyl)-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol
SMILES: COC1=CC=CC(=C1OC)C(C2CCN(CC2)CCC3=CC=C(C=C3)F)O

分子加工

分子式
C22H28FNO3
分子量
373.47
精确质量
373.2053
XLogP
3.83
TPSA
41.93
氢键给体数
1
氢键受体数
4
可旋转键
7
重原子数
27
环数
3
芳香环
2
饱和环
1
脂环
1
立体中心
1
未定义立体
1
形式电荷
0
杂原子数
5
共价单元
1
sp3占比
0.455
摩尔折射率
103.77

补充信息

InChIKey: HXTGXYRHXAGCFP-OAQYLSRUSA-N
同义词
Volinanserin139290-65-6MDL-100907M100907VolinanserinaVolinanserineMDL100.907DTXSID6047363MDL-100,907Mdl 100,907EW71EE171JM-100907(R)-(2,3-dimethoxyphenyl)-[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanolMDL-100.907DTXCID4027363alpha-(2,3-Dimethoxyphenyl)-1-(2-(4-fluorophenylethyl))-4-piperidine methanol(R)-(2,3-dimethoxyphenyl)(1-(2-(4-fluorophenyl)ethyl)piperidin-4-yl)methanol(+)-alpha-(2,3-Dimethoxyphenyl)-1-(2-(4-fluorophenyl)ethyl)-4-piperidinemethanolvolinanserinum(R)-(2,3-dimethoxyphenyl)-(1-(2-(4-fluorophenyl)ethyl)piperidin-4-yl)methanol(R)-(2,3-Dimethoxyphenyl){1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methanolMDL100105RefChem:9020494-piperidinemethanol, alpha-(2,3-dimethoxyphenyl)-1-(2-(4-fluorophenyl)ethyl)-, (alpha-R)-604-124-1Mdl 100907(R)-(2,3-Dimethoxyphenyl)(1-(4-fluorophenethyl)piperidin-4-yl)methanolVolinanserin [INN]MDL100907MFCD00909060
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参与 6 个反应