2-(4-methoxyphenyl)-1H-pyrrole
TL;DR: 2-(4-methoxyphenyl)-1H-pyrrole (CAS 4995-12-4) is a chemical compound with molecular formula C11H11NO and molecular weight 173.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyphenyl)-1H-pyrrole
Also Known As: 2-(4-methoxyphenyl)-1H-pyrrole, 2-(4-methoxyphenyl)pyrrole, 1H-Pyrrole, 2-(4-methoxyphenyl)-, 4-methoxy-1-pyrrol-2-ylbenzene, 2-(4-Methoxy-phenyl)-1H-pyrrole
| Molecular Formula | C11H11NO |
|---|---|
| Molecular Weight | 173.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 25.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.08406 |
| Heavy Atoms | 13 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 4995-12-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CC=CN2 |
| InChIKey | LRMKNDMDNZWNPB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-methoxyphenyl)-1H-pyrrole (CAS 4995-12-4), with molecular formula C11H11NO and molecular weight 173.08 g/mol. IUPAC: 2-(4-methoxyphenyl)-1H-pyrrole.
Chemical Property Profile of 2-(4-methoxyphenyl)-1H-pyrrole
Property Insights of 2-(4-methoxyphenyl)-1H-pyrrole
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-methoxyphenyl)-1H-pyrrole. With a topological polar surface area (TPSA) of 25.0 Ų, 2-(4-methoxyphenyl)-1H-pyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-methoxyphenyl)-1H-pyrrole has 1 hydrogen bond donor(s) and 1 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 2-(4-methoxyphenyl)-1H-pyrrole?
The CAS number of 2-(4-methoxyphenyl)-1H-pyrrole is 4995-12-4.
What is the molecular formula of 2-(4-methoxyphenyl)-1H-pyrrole?
The molecular formula of 2-(4-methoxyphenyl)-1H-pyrrole is C11H11NO.
What is the molecular weight of 2-(4-methoxyphenyl)-1H-pyrrole?
The molecular weight of 2-(4-methoxyphenyl)-1H-pyrrole is 173.08 g/mol.
Where can I buy 2-(4-methoxyphenyl)-1H-pyrrole?
You can request a quote for 2-(4-methoxyphenyl)-1H-pyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-methoxyphenyl)-1H-pyrrole?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-methoxyphenyl)-1H-pyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.