dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate
TL;DR: dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate (CAS 720677-11-2) is a chemical compound with molecular formula C15H15NO5 and molecular weight 289.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 1-(4-methoxyphenyl)pyrrole-2,5-dicarboxylate
Also Known As: dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate, dimethyl 1-(4-methoxyphenyl)pyrrole-2,5-dicarboxylate, AE-842/34023051
| Molecular Formula | C15H15NO5 |
|---|---|
| Molecular Weight | 289.10 g/mol |
| LogP | 2.0591 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.09503 |
| Heavy Atoms | 21 |
| Complexity | 623.70355 |
Chemical Identifiers
| CAS Number | 720677-11-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=CC=C2C(=O)OC)C(=O)OC |
Product Overview
dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate (CAS 720677-11-2), with molecular formula C15H15NO5 and molecular weight 289.10 g/mol. IUPAC: dimethyl 1-(4-methoxyphenyl)pyrrole-2,5-dicarboxylate.
Chemical Property Profile of dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate
Property Insights of dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate
The XLogP value of 2.0591 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate. Following Lipinski's Rule of Five, dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate has 0 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 dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate?
The CAS number of dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate is 720677-11-2.
What is the molecular formula of dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate?
The molecular formula of dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate is C15H15NO5.
What is the molecular weight of dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate?
The molecular weight of dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate is 289.10 g/mol.
Where can I buy dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate?
You can request a quote for dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for dimethyl 1-(4-methoxyphenyl)-1H-pyrrole-2,5-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.