beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester
TL;DR: beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester (CAS 36339-04-5) is a chemical compound with molecular formula C15H22N2O5 and molecular weight 310.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 3-(5-acetamido-2-methoxyanilino)propanoate
Also Known As: 2-methoxyethyl 3-(5-acetamido-2-methoxyanilino)propanoate, beta-Alanine, N-[5-(acetylamino)-2-methoxyphenyl]-, 2-methoxyethyl ester, N-(5-(Acetylamino)-2-methoxyphenyl)-beta-alanine, 2-methoxyethyl ester, .beta.-Alanine, N-[5-(acetylamino)-2-methoxyphenyl]-, 2-methoxyethyl ester, 2-methoxyethyl n-[5-(acetylamino)-2-methoxyphenyl]-
| Molecular Formula | C15H22N2O5 |
|---|---|
| Molecular Weight | 310.15 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 85.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 310.15286 |
| Heavy Atoms | 22 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 36339-04-5 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1)OC)NCCC(=O)OCCOC |
| InChIKey | JCXUJLWOJLTKRV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester (CAS 36339-04-5), with molecular formula C15H22N2O5 and molecular weight 310.15 g/mol. IUPAC: 2-methoxyethyl 3-(5-acetamido-2-methoxyanilino)propanoate.
Chemical Property Profile of beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester
Property Insights of beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester. The TPSA of 85.9 Ų falls within the moderate polarity range, balancing permeability and solubility for beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester. Following Lipinski's Rule of Five, beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester has 2 hydrogen bond donor(s) and 6 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 beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester?
The CAS number of beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester is 36339-04-5.
What is the molecular formula of beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester?
The molecular formula of beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester is C15H22N2O5.
What is the molecular weight of beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester?
The molecular weight of beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester is 310.15 g/mol.
Where can I buy beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester?
You can request a quote for beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester?
Yes, KEHONG BIO provides custom synthesis services for beta-Alanine, N-(5-(acetylamino)-2-methoxyphenyl)-, 2-methoxyethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.