2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole
TL;DR: 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole (CAS 125714-90-1) is a chemical compound with molecular formula C12H11Br2NO2 and molecular weight 358.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,5-dibromo-2,6-dimethoxyphenyl)-1H-pyrrole
Also Known As: 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole, NCI60_014061, 2-(3',5'-Dibrom-2',6'-dimethoxyphenyl)-1H-pyrrol, 2-(3,5-dibromo-2,6-dimethoxy-phenyl)-1H-pyrrole, 1,5-Dibromo-2,4-dimethoxy-3-(1H-pyrrol-2-yl)benzene
| Molecular Formula | C12H11Br2NO2 |
|---|---|
| Molecular Weight | 358.92 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 34.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.91565 |
| Heavy Atoms | 17 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 125714-90-1 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1Br)Br)OC)C2=CC=CN2 |
| InChIKey | VHAPZCVSMZGFMN-UHFFFAOYSA-N |
Product Overview
2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole (CAS 125714-90-1), with molecular formula C12H11Br2NO2 and molecular weight 358.92 g/mol. IUPAC: 2-(3,5-dibromo-2,6-dimethoxyphenyl)-1H-pyrrole.
Chemical Property Profile of 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole
Property Insights of 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole
The XLogP value of 3.7 indicates that 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.3 Ų, 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole has 1 hydrogen bond donor(s) and 2 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-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole?
The CAS number of 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole is 125714-90-1.
What is the molecular formula of 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole?
The molecular formula of 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole is C12H11Br2NO2.
What is the molecular weight of 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole?
The molecular weight of 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole is 358.92 g/mol.
Where can I buy 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole?
You can request a quote for 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-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-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,5-Dibromo-2,6-dimethoxyphenyl)-1H-pyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.