(2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid
TL;DR: (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid (CAS 312916-35-1) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid
Also Known As: Maybridge3_007445, N-Acetyl-3,4-dimethyl-L-phenylalanine, 2-(acetylamino)-3-(3,4-dimethylphenyl)propanoic acid, (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid
| Molecular Formula | C13H17NO3 |
|---|---|
| Molecular Weight | 235.12 g/mol |
| LogP | 1.43524 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 235.12085 |
| Heavy Atoms | 17 |
| Complexity | 440.29077 |
Chemical Identifiers
| CAS Number | 312916-35-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C[C@@H](C(=O)O)NC(=O)C)C |
Product Overview
(2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid (CAS 312916-35-1), with molecular formula C13H17NO3 and molecular weight 235.12 g/mol. IUPAC: (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid.
Chemical Property Profile of (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid
Property Insights of (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid
The XLogP value of 1.43524 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid. Following Lipinski's Rule of Five, (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid has 2 hydrogen bond donor(s) and 2 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 (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid?
The CAS number of (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid is 312916-35-1.
What is the molecular formula of (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid?
The molecular formula of (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid is C13H17NO3.
What is the molecular weight of (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid?
The molecular weight of (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid is 235.12 g/mol.
Where can I buy (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid?
You can request a quote for (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-acetamido-3-(3,4-dimethylphenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.