1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole
TL;DR: 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole (CAS 5044-27-9) is a chemical compound with molecular formula C13H15NO and molecular weight 201.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)-2,5-dimethylpyrrole
Also Known As: 1-(4-methoxyphenyl)-2,5-dimethylpyrrole, 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole, OSM-S-289, 2,5-Dimethyl-1-(p-anisyl)pyrrole, 4426AE
| Molecular Formula | C13H15NO |
|---|---|
| Molecular Weight | 201.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 14.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.11537 |
| Heavy Atoms | 15 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 5044-27-9 |
|---|---|
| SMILES | CC1=CC=C(N1C2=CC=C(C=C2)OC)C |
| InChIKey | ZJXMRHDTQFPICU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole (CAS 5044-27-9), with molecular formula C13H15NO and molecular weight 201.12 g/mol. IUPAC: 1-(4-methoxyphenyl)-2,5-dimethylpyrrole.
Chemical Property Profile of 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole
Property Insights of 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole
The XLogP value of 3.1 indicates that 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 14.2 Ų, 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole has 0 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 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole?
The CAS number of 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole is 5044-27-9.
What is the molecular formula of 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole?
The molecular formula of 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole is C13H15NO.
What is the molecular weight of 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole?
The molecular weight of 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole is 201.12 g/mol.
Where can I buy 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole?
You can request a quote for 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.