L-Alanine, N-[(4-methylphenyl)sulfonyl]-, 1H-indol-3-yl ester


Chemical Name: L-Alanine, N-[(4-methylphenyl)sulfonyl]-, 1H-indol-3-yl ester
CAS Number: 75062-54-3
Product Number: AG0056SV(AGN-PC-0OHKTN)
Synonyms:
MDL No:
Molecular Formula: C18H18N2O4S
Molecular Weight: 358.4115

Identification/Properties


Properties
MP:
38-60°C
BP:
577.9°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
358.412g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
358.099g/mol
Monoisotopic Mass:
358.099g/mol
Topological Polar Surface Area:
96.6A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
566
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H317
Precautionary Statements:
P280
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



(S)-1H-Indol-3-yl 2-(4-methylphenylsulfonamido)propanoate, also known as $name$, plays a crucial role in chemical synthesis as a versatile building block. With its unique structure and reactivity, this compound is commonly utilized as a key intermediate in the synthesis of various pharmaceuticals, agrochemicals, and fine chemicals.In chemical synthesis, (S)-1H-Indol-3-yl 2-(4-methylphenylsulfonamido)propanoate serves as a valuable starting material for the preparation of complex molecules. Its indole moiety provides a rich source of aromaticity and functional group diversity, allowing for efficient derivatization and modification. The sulfonamide group attached to the propanoate side chain enhances the compound's solubility and compatibility in a wide range of reaction conditions.One of the prominent applications of (S)-1H-Indol-3-yl 2-(4-methylphenylsulfonamido)propanoate is in the synthesis of bioactive compounds such as pharmaceutical drugs and plant protection agents. By incorporating this compound into synthetic pathways, chemists can access structurally diverse molecules with potential therapeutic or agricultural benefits. Additionally, the chirality of the compound further expands its synthetic utility, enabling the selective formation of enantiomerically pure products.Overall, (S)-1H-Indol-3-yl 2-(4-methylphenylsulfonamido)propanoate emerges as a valuable tool in the hands of synthetic chemists, offering a reliable and efficient way to access a wide range of functionalized molecules with tailored properties and activities.