Methyl 2-(4-Methylphenylsulfonamido)-2-Phenylacetate 2-(4-甲基苯基磺酰氨基)-2-苯基乙酸甲酯

CAS 1233-56-3 MFCD00664343

化学结构图

1233-56-3
SMILES: COC(=O)C(NS(=O)(=O)c1ccc(C)cc1)c1ccccc1

化学属性

Mol. FormulaC16H17NO4S
Mol. Weight319.38
Melting Point113-115 °C
Boiling Point473.5°C at 760 mmHg

别名和识别编码

Chemical NameMethyl 2-(4-Methylphenylsulfonamido)-2-Phenylacetate
CAS Number1233-56-3
Alfabeta NameMETHYLMETHYLPHENYLSULFONYLAMINOPHENYLACETATE 242[]()----{}
MDL NumberMFCD00664343
Chemical Name Translation2-(4-甲基苯基磺酰氨基)-2-苯基乙酸甲酯
LabNetwork Molecule IDLN00144725
PubChem Substance ID2765029
InChIInChI=1S/C16H17NO4S/c1-12-8-10-14(11-9-12)22(19,20)17-15(16(18)21-2)13-6-4-3-5-7-13/h3-11,15,17H,1-2H3
Synonym Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {} {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {} {} {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {} {} {} {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {} {} {} {} {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {} {} {} {} {} {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {} {} {} {} {} {} {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {} {} {} {} {} {} {} {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {} {} {} {} {} {} {} {} {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {} {} {} {} {} {} {} {} {} {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate {} {} {} {} {} {} {} {} {} {} {}
Canonical SMILESCC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C(=O)OC
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分类

  • {KO} Sulphonamides
  • {KO} Esters

安全信息

Warnings IRRITANT
Storage condition

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
4
Rotatable Bonds
6
H-bond Donors
1
LogP
2

系列性分类

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