N-Benzoyl-2-methylalanine
TL;DR: N-Benzoyl-2-methylalanine (CAS 59082-04-1) 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.
2-benzamido-2-methylpropanoic acid
Also Known As: N-benzoyl-2-methylalanine, dimethylhippuric acid, 2-benzamido-2-methylpropanoic acid, Alanine, N-benzoyl-2-methyl-, 2-methyl-2-(phenylformamido)propanoic acid
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 59082-04-1 |
|---|---|
| SMILES | CC(C)(C(=O)O)NC(=O)C1=CC=CC=C1 |
| InChIKey | AXAMLHJXUICVAY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Benzoyl-2-methylalanine (CAS 59082-04-1), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: 2-benzamido-2-methylpropanoic acid.
Chemical Property Profile of N-Benzoyl-2-methylalanine
Property Insights of N-Benzoyl-2-methylalanine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzoyl-2-methylalanine. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Benzoyl-2-methylalanine. Following Lipinski's Rule of Five, N-Benzoyl-2-methylalanine has 2 hydrogen bond donor(s) and 3 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 N-Benzoyl-2-methylalanine?
The CAS number of N-Benzoyl-2-methylalanine is 59082-04-1.
What is the molecular formula of N-Benzoyl-2-methylalanine?
The molecular formula of N-Benzoyl-2-methylalanine is C11H13NO3.
What is the molecular weight of N-Benzoyl-2-methylalanine?
The molecular weight of N-Benzoyl-2-methylalanine is 207.09 g/mol.
Where can I buy N-Benzoyl-2-methylalanine?
You can request a quote for N-Benzoyl-2-methylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzoyl-2-methylalanine?
Yes, KEHONG BIO provides custom synthesis services for N-Benzoyl-2-methylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.