(2S)-2-[(3-methylbenzoyl)amino]propanoic acid
TL;DR: (2S)-2-[(3-methylbenzoyl)amino]propanoic acid (CAS 956505-60-5) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(3-methylbenzoyl)amino]propanoic acid
Also Known As: (3-Methylbenzoyl)-l-alanine, (2S)-2-[(3-methylbenzoyl)amino]propanoic acid, (2S)-2-[(3-methylphenyl)formamido]propanoic acid, L-Alanine, N-(3-methylbenzoyl), 2-[(3-methylbenzoyl)amino]propanoic Acid
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 1.19792 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 387.17435 |
Chemical Identifiers
| CAS Number | 956505-60-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)N[C@@H](C)C(=O)O |
Product Overview
(2S)-2-[(3-methylbenzoyl)amino]propanoic acid (CAS 956505-60-5), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: (2S)-2-[(3-methylbenzoyl)amino]propanoic acid.
Chemical Property Profile of (2S)-2-[(3-methylbenzoyl)amino]propanoic acid
Property Insights of (2S)-2-[(3-methylbenzoyl)amino]propanoic acid
The XLogP value of 1.19792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-[(3-methylbenzoyl)amino]propanoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-[(3-methylbenzoyl)amino]propanoic acid. Following Lipinski's Rule of Five, (2S)-2-[(3-methylbenzoyl)amino]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-[(3-methylbenzoyl)amino]propanoic acid?
The CAS number of (2S)-2-[(3-methylbenzoyl)amino]propanoic acid is 956505-60-5.
What is the molecular formula of (2S)-2-[(3-methylbenzoyl)amino]propanoic acid?
The molecular formula of (2S)-2-[(3-methylbenzoyl)amino]propanoic acid is C11H13NO3.
What is the molecular weight of (2S)-2-[(3-methylbenzoyl)amino]propanoic acid?
The molecular weight of (2S)-2-[(3-methylbenzoyl)amino]propanoic acid is 207.09 g/mol.
Where can I buy (2S)-2-[(3-methylbenzoyl)amino]propanoic acid?
You can request a quote for (2S)-2-[(3-methylbenzoyl)amino]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-[(3-methylbenzoyl)amino]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-[(3-methylbenzoyl)amino]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.