名称: 2-(2-chloroethyl)-4-methyl-2,3-dihydropyrido[3,2-f][1,4]oxazepine-5-thione
SMILES:
CN1CC(OC2=C(C1=S)C=CC=N2)CCCl分子加工
分子式
C11H13ClN2OS
分子量
256.76
精确质量
256.0437
XLogP
2.08
TPSA
25.36
氢键给体数
0
氢键受体数
3
可旋转键
2
重原子数
16
环数
2
芳香环
1
饱和环
0
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
68.32
补充信息
InChIKey: WVSHDPAFBXVZGC-UHFFFAOYSA-N
同义词
SCHEMBL10369025WVSHDPAFBXVZGC-UHFFFAOYSA-N2-(2-Chlorethyl)-2,3-dihydro-4-methylpyrido[3,2-f][1,4]oxazepine-5(4H)-thione2-(2-chloroethyl)-2,3-dihydro-4-methylpyrido[3,2-f]-1,4-oxazepine-5(4H)-thione2-(2-chloroethyl)-2,3-dihydro-4-methylpyrido[3,2-f][1,4]-oxazepine-5(4H)-thione2-(2-chloroethyl)-2,3-dihydro-4-methylpyrido[3,2-f][1,4]-oxazepine-5(4H)thione2-(2-Chloroethyl)-2,3-dihydro-4-methylpyrido[3,2-f][1,4]oxazepine-5(4H)-thione2-(2-chloroethyl)-2,5-dihydro-4-methylpyrido[3,2-f]-1,4-oxazepine-5(4H)-thione2-(chloroethyl)-2,3-dihydro-4-methylpyrido[3,2-f]-1,4-oxazepine-5(4H)-thione2-(chloroethyl)-2,3-dihydro-4-methylpyrido[3,2-f]-1,4-oxazepine-5(4H)thione2-chloroethyl-2,3-dihydro-4-methylpyrido[3,2-f]-1,4-oxazepine-5(4H)-thione
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