1233958-22-9 ((Tert-Butyl 4-(4-methoxyphenylsulfonamido)piperidine-1-carboxylate)

CAS号:
1233958-22-9
英文名称:
Tert-Butyl 4-(4-methoxyphenylsulfonamido)piperidine-1-carboxylate
分子式:
C17H26N2O5S
分子量:
370.463743686676

Tert-Butyl 4-(4-methoxyphenylsulfonamido)piperidine-1-carboxylate(1233958-22-9)名称与标识符

名称

英文别名:
tert-Butyl 4-(4-methoxyphenylsulfonamido)piperidine-1-carboxylate;Z786329770;tert-butyl 4-(4-methoxybenzenesulfonamido)piperidine-1-carboxylate;

标识符

InChIKey:
BRGQMDGAWSQGKO-UHFFFAOYSA-N
Inchi:
1S/C17H26N2O5S/c1-17(2,3)24-16(20)19-11-9-13(10-12-19)18-25(21,22)15-7-5-14(23-4)6-8-15/h5-8,13,18H,9-12H2,1-4H3
SMILES:
S(C1C=CC(=CC=1)OC)(NC1CCN(C(=O)OC(C)(C)C)CC1)(=O)=O

Tert-Butyl 4-(4-methoxyphenylsulfonamido)piperidine-1-carboxylate(1233958-22-9)物化性质

计算特性

  • 氢键供体数量 : 1
  • 氢键受体数量 : 6
  • 可旋转化学键数量 : 6
  • 重原子数量 : 25
  • 复杂度 : 536
  • 疏水参数计算参考值(XlogP) : 2.3
  • 拓扑分子极性表面积 : 93.3