ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate
TL;DR: ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate (CAS 866040-72-4) is a chemical compound with molecular formula C17H22N2O2 and molecular weight 286.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4-aminophenyl)-3-(2,5-dimethylpyrrol-1-yl)propanoate
Also Known As: Bionet2_001178, ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate, ethyl 3-(4-aminophenyl)-3-(2,5-dimethylpyrrol-1-yl)propanoate, ethyl3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate, 3-(4-aminophenyl)-3-(2,5-dimethyl-1-pyrrolyl)propanoic acid ethyl ester
| Molecular Formula | C17H22N2O2 |
|---|---|
| Molecular Weight | 286.17 g/mol |
| LogP | 3.22974 |
| Topological Polar Surface Area | 57.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.16812 |
| Heavy Atoms | 21 |
| Complexity | 594.7204 |
Chemical Identifiers
| CAS Number | 866040-72-4 |
|---|---|
| SMILES | CCOC(=O)CC(C1=CC=C(C=C1)N)N2C(=CC=C2C)C |
Product Overview
ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate (CAS 866040-72-4), with molecular formula C17H22N2O2 and molecular weight 286.17 g/mol. IUPAC: ethyl 3-(4-aminophenyl)-3-(2,5-dimethylpyrrol-1-yl)propanoate.
Chemical Property Profile of ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate
Property Insights of ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate
The XLogP value of 3.22974 indicates that ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.25 Ų, ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate has 1 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 ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate?
The CAS number of ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate is 866040-72-4.
What is the molecular formula of ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate?
The molecular formula of ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate is C17H22N2O2.
What is the molecular weight of ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate?
The molecular weight of ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate is 286.17 g/mol.
Where can I buy ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate?
You can request a quote for ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-(4-aminophenyl)-3-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.