N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester
TL;DR: N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester (CAS 24310-35-8) is a chemical compound with molecular formula C13H15NO5 and molecular weight 265.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(N-(2-ethoxy-2-oxoacetyl)anilino)propanoic acid
Also Known As: n-[ethoxy(oxo)acetyl]-n-phenyl-, A-alanine, N-[Ethoxy(oxo)acetyl]-N-phenyl-beta-alanine, N-(2-CARBOXYETHYL)OXANILIC ACID, 1-ETHYL ESTER, 3-(N-(2-ethoxy-2-oxoacetyl)anilino)propanoic acid
| Molecular Formula | C13H15NO5 |
|---|---|
| Molecular Weight | 265.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 265.09503 |
| Heavy Atoms | 19 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 24310-35-8 |
|---|---|
| SMILES | CCOC(=O)C(=O)N(CCC(=O)O)C1=CC=CC=C1 |
| InChIKey | KTXRBUULPNFHNV-UHFFFAOYSA-N |
Product Overview
N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester (CAS 24310-35-8), with molecular formula C13H15NO5 and molecular weight 265.10 g/mol. IUPAC: 3-(N-(2-ethoxy-2-oxoacetyl)anilino)propanoic acid.
Chemical Property Profile of N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester
Property Insights of N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester. Following Lipinski's Rule of Five, N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester has 1 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 N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester?
The CAS number of N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester is 24310-35-8.
What is the molecular formula of N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester?
The molecular formula of N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester is C13H15NO5.
What is the molecular weight of N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester?
The molecular weight of N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester is 265.10 g/mol.
Where can I buy N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester?
You can request a quote for N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Carboxyethyl)oxanilic acid, 1-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.