methyl 3-(N-(4-aminophenyl)acetamido)propanoate
TL;DR: methyl 3-(N-(4-aminophenyl)acetamido)propanoate (CAS 347343-89-9) is a chemical compound with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(N-acetyl-4-aminoanilino)propanoate
Also Known As: methyl 3-(N-acetyl-4-aminoanilino)propanoate, methyl 3-(N-(4-aminophenyl)acetamido)propanoate, methyl N-acetyl-N-(4-aminophenyl)-beta-alaninate
| Molecular Formula | C12H16N2O3 |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 72.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 236.11609 |
| Heavy Atoms | 17 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 347343-89-9 |
|---|---|
| SMILES | CC(=O)N(CCC(=O)OC)C1=CC=C(C=C1)N |
| InChIKey | GYUHFLKVQOIMBV-UHFFFAOYSA-N |
Product Overview
methyl 3-(N-(4-aminophenyl)acetamido)propanoate (CAS 347343-89-9), with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol. IUPAC: methyl 3-(N-acetyl-4-aminoanilino)propanoate.
Chemical Property Profile of methyl 3-(N-(4-aminophenyl)acetamido)propanoate
Property Insights of methyl 3-(N-(4-aminophenyl)acetamido)propanoate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-(N-(4-aminophenyl)acetamido)propanoate. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-(N-(4-aminophenyl)acetamido)propanoate. Following Lipinski's Rule of Five, methyl 3-(N-(4-aminophenyl)acetamido)propanoate has 1 hydrogen bond donor(s) and 4 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 methyl 3-(N-(4-aminophenyl)acetamido)propanoate?
The CAS number of methyl 3-(N-(4-aminophenyl)acetamido)propanoate is 347343-89-9.
What is the molecular formula of methyl 3-(N-(4-aminophenyl)acetamido)propanoate?
The molecular formula of methyl 3-(N-(4-aminophenyl)acetamido)propanoate is C12H16N2O3.
What is the molecular weight of methyl 3-(N-(4-aminophenyl)acetamido)propanoate?
The molecular weight of methyl 3-(N-(4-aminophenyl)acetamido)propanoate is 236.12 g/mol.
Where can I buy methyl 3-(N-(4-aminophenyl)acetamido)propanoate?
You can request a quote for methyl 3-(N-(4-aminophenyl)acetamido)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-(N-(4-aminophenyl)acetamido)propanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-(N-(4-aminophenyl)acetamido)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.