3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione
TL;DR: 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione (CAS 53663-24-4) is a chemical compound with molecular formula C13H12BrNO2 and molecular weight 293.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-1-(2-ethyl-6-methylphenyl)pyrrole-2,5-dione
Also Known As: 3-bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione, AB00081757-01, 3-bromo-1-(2-ethyl-6-methylphenyl)pyrrole-2,5-dione
| Molecular Formula | C13H12BrNO2 |
|---|---|
| Molecular Weight | 293.01 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 293.00513 |
| Heavy Atoms | 17 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 53663-24-4 |
|---|---|
| SMILES | CCC1=CC=CC(=C1N2C(=O)C=C(C2=O)Br)C |
| InChIKey | GQAPYUCFLDQLQV-UHFFFAOYSA-N |
Product Overview
3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione (CAS 53663-24-4), with molecular formula C13H12BrNO2 and molecular weight 293.01 g/mol. IUPAC: 3-bromo-1-(2-ethyl-6-methylphenyl)pyrrole-2,5-dione.
Chemical Property Profile of 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione
Property Insights of 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione
The XLogP value of 3.1 indicates that 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione has 0 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 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione?
The CAS number of 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione is 53663-24-4.
What is the molecular formula of 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione?
The molecular formula of 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione is C13H12BrNO2.
What is the molecular weight of 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione?
The molecular weight of 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione is 293.01 g/mol.
Where can I buy 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione?
You can request a quote for 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-1-(2-ethyl-6-methylphenyl)-1h-pyrrole-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.