![Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester structure](/static/products/1244/124482-53-7.webp)
Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester
TL;DR: Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester (CAS 124482-53-7) is a chemical compound with molecular formula C15H21NO4S and molecular weight 311.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-(N-(2-methoxyacetyl)-2-methyl-6-methylsulfanylanilino)propanoate
Also Known As: Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester, Alanine, N-(methoxyacetyl)-N-(2-methyl-6-(methylthio)phenyl)-, methyl ester, Methyl N-(methoxyacetyl)-N-[2-methyl-6-(methylsulfanyl)phenyl]-L-alaninate, methyl (2S)-2-(N-(2-methoxyacetyl)-2-methyl-6-methylsulfanylanilino)propanoate, Methyl (2S)-2-[(2-methoxyacetyl)-(2-methyl-6-methylsulfanyl-phenyl)amino]propanoate
| Molecular Formula | C15H21NO4S |
|---|---|
| Molecular Weight | 311.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 81.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 311.11914 |
| Heavy Atoms | 21 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 124482-53-7 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)SC)N([C@@H](C)C(=O)OC)C(=O)COC |
| InChIKey | BKBBSMLBUUNVIM-NSHDSACASA-N |
Product Overview
Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester (CAS 124482-53-7), with molecular formula C15H21NO4S and molecular weight 311.12 g/mol. IUPAC: methyl (2S)-2-(N-(2-methoxyacetyl)-2-methyl-6-methylsulfanylanilino)propanoate.
Chemical Property Profile of Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester
Property Insights of Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester. Following Lipinski's Rule of Five, Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester?
The CAS number of Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester is 124482-53-7.
What is the molecular formula of Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester?
The molecular formula of Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester is C15H21NO4S.
What is the molecular weight of Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester?
The molecular weight of Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester is 311.12 g/mol.
Where can I buy Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester?
You can request a quote for Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Alanine, N-(methoxyacetyl)-N-[2-methyl-6-(methylthio)phenyl]-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.