beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester
TL;DR: beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester (CAS 68133-26-6) is a chemical compound with molecular formula C13H20N2O4 and molecular weight 268.1423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methoxyethyl 3-(5-amino-2-methoxyanilino)propanoate
Also Known As: 2-Methoxyethyl N-(5-amino-2-methoxyphenyl)-beta-alaninate, N-(5-Amino-2-methoxyphenyl)-beta-alanine, 2-methoxyethyl ester, .beta.-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester, 2-methoxyethyl 3-(5-amino-2-methoxyanilino)propanoate, 2-methoxyethyl n-(5-amino-2-methoxyphenyl)-
Technical Specifications
| Molecular Formula | C13H20N2O4 |
| Molecular Weight | 268.1423 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 82.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 268.1423 Da |
| Heavy Atoms | 19 |
| Complexity | 263.0 |
| SMILES | COCCOC(=O)CCNC1=C(C=CC(=C1)N)OC |
| InChIKey | AZQGFJYXVUIQEN-UHFFFAOYSA-N |
Chemical Property Profile of beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester
Property Insights of beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester. The TPSA of 82.8 Ų falls within the moderate polarity range, balancing permeability and solubility for beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester. Following Lipinski's Rule of Five, beta-Alanine, N-(5-amino-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
What is the CAS number of beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester?
The CAS number of beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester is 68133-26-6.
What is the molecular formula of beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester?
The molecular formula of beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester is C13H20N2O4.
What is the molecular weight of beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester?
The molecular weight of beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester is 268.1423 g/mol.
Where can I buy beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester?
You can request a quote for beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester?
Yes, CoreyChem provides custom synthesis services for beta-Alanine, N-(5-amino-2-methoxyphenyl)-, 2-methoxyethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.