473554-15-3 ((2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide,(2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide)

快速询单

结构式：

(2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxideMOL文件

CAS号：

473554-15-3

中文名称：

(2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide

英文名称：

(2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide

分子式：

C₁₆H₁₇NO₄S₂

分子量：

351.440481901169

(2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide(473554-15-3)名称与标识符

名称

中文别名：

(2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide;

英文别名：

(2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide;

标识符

InChIKey：

GFVLQDUEPBMSBN-UMLSUDCWSA-N

Inchi：

1S/C16H17NO4S2/c1-12-8-10-15(11-9-12)23(19,20)17-13(2)16(21-22(17)18)14-6-4-3-5-7-14/h3-11,13,16H,1-2H3/t13-,16-,22+/m0/s1

SMILES：

S(C1C=CC(C)=CC=1)(N1[C@@H](C)[C@@H](C2C=CC=CC=2)O[S@]1=O)(=O)=O

(2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide(473554-15-3)物化性质

计算特性

氢键供体数量 : 0
氢键受体数量 : 6
可旋转化学键数量 : 3
重原子数量 : 23
复杂度 : 531
疏水参数计算参考值（XlogP） : 3
拓扑分子极性表面积 : 91.3

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473554-15-3 ((2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide,(2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide)

(2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide(473554-15-3)名称与标识符

名称

标识符

(2R,4S,5R)-4-methyl-3-(4-methylphenyl)sulfonyl-5-phenyloxathiazolidine 2-oxide(473554-15-3)物化性质

计算特性

目录